data_2rsy_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 2rsy _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 ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.723 0.218 . . . . 75.32 112.319 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 48.9 p-90 -54.86 -26.32 34.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 64.42 110.915 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -89.17 100.55 13.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.27 -0.423 . . . . 71.11 110.885 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 -75.62 -37.06 60.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 75.54 110.834 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 56.24 20.56 29.27 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.703 -0.76 . . . . 72.14 112.501 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.32 79.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.684 0.278 . . . . 65.14 110.857 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 24.4 mm -144.19 144.82 22.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 75.43 111.076 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 p -96.57 177.08 5.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 62.4 111.167 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -66.03 -39.04 89.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.278 -0.419 . . . . 73.55 110.811 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -69.59 -34.75 74.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 71.3 110.893 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -36.63 61.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 74.43 110.899 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.06 -34.0 61.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 73.12 111.028 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.24 -53.4 37.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.234 -0.439 . . . . 70.43 110.855 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.87 -39.17 93.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 75.31 110.916 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 17.3 mt -57.5 -38.44 74.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 74.41 110.913 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -101.89 43.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 75.3 110.931 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.472 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.93 -60.35 4.48 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.674 0.75 . . . . 75.34 110.982 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.472 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.71 123.13 9.82 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.735 2.29 . . . . 75.34 112.341 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 118.08 5.47 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.713 2.275 . . . . 72.15 112.273 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.89 104.4 2.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.445 . . . . 71.11 110.888 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.6 p -56.82 111.93 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.108 -0.496 . . . . 71.41 111.143 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.85 -8.83 6.09 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.718 -0.753 . . . . 45.24 112.435 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.7 tp -89.74 111.78 22.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.84 0.352 . . . . 74.54 110.901 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -123.75 163.9 20.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 74.32 110.857 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -159.2 136.99 10.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.213 -0.449 . . . . 73.42 110.918 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 86.3 t -110.23 137.38 42.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.166 -0.47 . . . . 70.32 111.125 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -150.69 145.58 25.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 73.35 110.912 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.5 124.09 11.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 65.33 110.958 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 t -60.46 114.42 2.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.184 -0.462 . . . . 74.4 110.851 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.3 m -68.73 -53.17 23.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 71.34 111.143 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -63.49 -29.38 70.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 73.54 110.862 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -125.97 96.11 38.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.667 0.746 . . . . 74.23 110.947 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.66 127.09 14.17 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.69 2.26 . . . . 73.42 112.314 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.4 -15.72 22.37 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.72 -0.752 . . . . 51.01 112.472 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -117.59 179.23 4.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.89 0.376 . . . . 73.15 110.868 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -124.68 162.81 23.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.118 -0.492 . . . . 75.21 110.924 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 89.8 m -134.72 126.45 29.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.122 -0.49 . . . . 65.51 111.136 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.23 119.83 37.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.915 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.5 t -105.94 122.44 46.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 73.04 110.902 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.7 t -122.67 151.01 26.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.268 -0.423 . . . . 73.25 111.121 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.54 111.0 23.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.868 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.47 94.59 4.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 71.53 110.881 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 66.23 29.88 9.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 72.4 110.905 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.87 -13.17 63.93 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.72 -0.753 . . . . 72.33 112.492 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -88.01 140.06 29.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.836 0.35 . . . . 74.43 110.906 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 8.8 m -101.25 107.88 22.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 71.43 111.111 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -97.05 123.05 40.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 74.32 110.865 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -102.41 125.17 49.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 74.45 110.895 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -113.01 112.56 24.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 73.23 110.924 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.37 132.79 48.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.092 -0.504 . . . . 75.14 110.884 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 29.3 mt -113.19 110.1 30.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.224 -0.444 . . . . 74.44 111.18 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.04 128.56 34.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 75.11 110.904 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -115.42 101.37 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.411 . . . . 75.01 110.888 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -136.49 142.57 43.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.479 . . . . 74.21 110.848 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.14 35.96 25.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 73.01 111.169 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.28 29.6 19.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 73.03 110.825 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -136.23 142.3 44.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.08 -0.509 . . . . 74.51 110.905 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mp -103.86 150.06 24.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.25 -0.432 . . . . 73.13 110.9 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 33.8 t -167.37 140.45 3.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.161 -0.472 . . . . 74.22 110.846 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 58.9 mt -115.7 -28.76 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.143 -0.481 . . . . 65.2 111.125 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -95.28 -1.74 50.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 75.14 110.875 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 61.57 17.03 8.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 64.4 110.862 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -127.49 -33.99 2.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 74.23 110.882 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -112.21 104.58 17.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.112 -0.494 . . . . 63.32 111.09 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -97.79 143.98 27.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 73.52 111.01 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -118.55 178.07 4.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 75.34 110.875 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.55 -15.44 17.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 74.23 110.859 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -165.39 172.27 12.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.175 -0.466 . . . . 71.02 110.93 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.63 -24.78 58.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.168 -0.469 . . . . 75.25 110.909 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.3 tmm? -61.54 -57.09 13.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.271 -0.422 . . . . 73.41 110.903 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.65 -36.1 82.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 75.24 110.94 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.69 -48.27 75.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.439 . . . . 73.05 110.92 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 73.6 t -64.84 -37.43 80.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 72.51 111.19 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -56.1 -38.12 70.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 74.21 110.887 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.09 -44.33 63.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.47 . . . . 75.5 110.879 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -71.1 -16.14 62.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 74.12 110.925 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 95.4 m -87.02 -33.3 19.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.501 . . . . 72.34 111.123 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.4 t -80.52 -24.29 39.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 64.01 111.153 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -157.47 155.01 29.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 71.13 110.845 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.18 -57.46 8.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 73.32 111.102 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 60.01 20.75 9.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 74.14 110.866 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.78 17.24 7.54 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.756 -0.735 . . . . 75.22 112.507 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 9.7 mp -111.18 139.13 46.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.833 0.349 . . . . 72.03 110.935 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 38.4 t -51.37 -31.76 23.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 74.52 110.904 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 5.3 t -156.02 124.42 5.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 34.02 111.174 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -51.43 146.87 6.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 73.13 110.78 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.7 mt -65.74 138.45 57.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.144 -0.48 . . . . 73.34 110.901 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 26.4 mt -127.24 -51.31 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.168 -0.469 . . . . 73.21 111.132 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 1.8 mmtp -129.2 121.98 20.87 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.605 0.717 . . . . 71.4 110.902 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 138.24 37.6 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.718 2.278 . . . . 64.44 112.3 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.46 83.36 0.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 75.24 110.88 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.5 m -64.46 134.91 28.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 75.42 111.148 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.5 ptm . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 73.04 110.853 179.943 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.812 0.339 . . . . 71.14 110.944 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.6 t -96.2 88.95 4.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 53.32 110.882 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -71.47 147.09 48.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 64.53 110.869 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.06 129.48 21.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.11 -0.495 . . . . 74.1 110.869 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.86 161.29 14.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 74.44 110.851 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -61.33 -17.74 55.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 74.15 110.875 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -36.99 84.62 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.132 -0.485 . . . . 73.44 110.914 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -100.33 -20.61 15.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 74.34 110.933 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -147.82 79.07 9.52 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.619 0.724 . . . . 65.22 110.825 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -6.54 18.85 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.678 2.252 . . . . 75.54 112.35 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.3 t -94.05 27.47 2.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.23 -0.441 . . . . 62.41 111.129 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 47.6 mt -100.64 136.94 39.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.247 -0.433 . . . . 74.41 110.875 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.2 t -108.96 172.34 6.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 62.54 111.158 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -48.98 -34.16 12.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.2 -0.455 . . . . 71.33 110.93 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -64.28 -45.09 89.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 72.32 110.895 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -74.31 -50.21 19.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.49 . . . . 71.14 110.847 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 40.6 mm -55.69 -53.05 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 71.44 111.131 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 25.0 m -62.74 -32.48 73.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 54.11 110.851 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -62.88 -16.56 59.27 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.146 -0.479 . . . . 75.15 111.145 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 74.15 110.905 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.846 0.355 . . . . 74.01 110.864 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 3.1 m 63.88 158.03 0.08 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 74.11 110.876 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 4.7 m -51.61 123.21 2.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.145 -0.479 . . . . 65.33 111.196 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -137.87 77.67 1.64 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 73.2 110.852 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp . . . . . 0 C--N 1.329 -0.293 0 CA-C-O 121.534 0.683 . . . . 75.54 110.957 179.909 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.153 0 CA-C-O 120.737 0.224 . . . . 60.42 112.316 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 38.0 p-90 -102.76 -30.13 11.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 75.43 110.871 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -87.42 97.22 10.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 75.42 110.908 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.77 -37.48 59.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 72.02 110.894 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.7 25.94 56.57 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.704 -0.76 . . . . 65.31 112.474 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.26 67.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.726 0.298 . . . . 74.42 110.91 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 15.5 mm -128.41 144.12 38.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 73.21 111.111 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.87 171.23 8.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.153 -0.476 . . . . 74.33 111.198 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -62.03 -39.08 91.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 74.45 110.829 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -75.15 -32.8 61.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 55.54 110.952 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -69.97 -41.38 74.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.161 -0.472 . . . . 73.22 110.888 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.26 -36.55 63.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 71.34 111.051 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.64 -53.21 60.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 75.32 110.887 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.45 -34.08 76.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 73.32 110.884 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 9.5 mt -54.88 -38.42 67.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 72.04 110.938 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -100.27 43.57 1.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 73.41 110.894 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.503 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.38 -59.47 4.91 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.712 0.768 . . . . 74.43 110.902 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 52.7 Cg_endo -69.78 123.74 10.39 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.74 2.294 . . . . 73.11 112.304 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 115.63 4.19 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.639 2.226 . . . . 73.2 112.3 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -155.34 121.03 5.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.254 -0.43 . . . . 65.53 110.871 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -72.39 111.74 7.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.097 -0.501 . . . . 75.2 111.128 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.28 -4.32 6.76 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.696 -0.764 . . . . 72.02 112.481 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 3.8 tp -90.24 120.92 31.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.908 0.385 . . . . 75.23 110.895 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.7 p90 -133.05 175.94 8.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.118 -0.492 . . . . 73.13 110.919 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -169.47 134.27 1.43 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 74.25 110.863 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 84.7 t -110.93 131.4 62.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 75.02 111.161 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.66 150.81 36.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 74.5 110.863 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -57.5 124.08 17.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 74.53 110.927 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.5 m -57.94 117.1 3.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.868 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.9 m -69.01 -56.17 8.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 74.14 111.071 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -71.97 -26.76 62.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 74.51 110.913 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -108.42 90.63 7.31 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.655 0.74 . . . . 70.24 110.922 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 113.56 3.41 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.71 2.273 . . . . 73.03 112.339 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.44 2.62 24.4 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.704 -0.76 . . . . 73.24 112.512 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -130.78 -172.62 2.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.82 0.343 . . . . 73.02 110.853 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -140.52 145.23 36.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.882 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 31.6 m -108.95 128.22 54.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 64.32 111.12 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.86 104.7 13.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 72.22 110.916 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.3 m -87.21 153.91 21.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.185 -0.461 . . . . 74.54 110.843 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.8 t -146.58 142.66 20.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 71.55 111.192 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.13 111.29 22.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 64.55 110.803 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -123.23 93.55 3.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 75.44 110.905 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 67.5 29.27 7.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 73.13 110.837 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.68 -19.05 56.18 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.741 -0.742 . . . . 74.22 112.464 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -87.44 136.68 32.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.851 0.358 . . . . 73.15 110.891 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.1 p -97.26 106.73 18.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 74.43 111.105 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -91.95 120.19 32.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.123 -0.49 . . . . 64.4 110.924 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -87.79 124.72 33.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 74.31 110.878 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -114.14 106.8 14.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 75.4 110.919 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -64.06 141.28 58.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 73.31 110.905 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 61.9 mt -123.25 111.25 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 75.13 111.13 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.32 125.07 31.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 74.14 110.862 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -111.77 98.27 7.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 75.31 110.947 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -130.83 142.56 50.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 65.43 110.872 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.2 35.96 25.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 74.04 111.182 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.44 29.32 18.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.473 . . . . 73.35 110.861 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mtmm -134.1 139.93 46.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 74.55 110.91 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.8 mp -102.01 149.21 24.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.271 -0.422 . . . . 73.32 110.934 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.2 p -165.69 140.57 4.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 71.3 110.901 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 50.1 mt -115.56 -32.5 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 74.12 111.155 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -89.64 1.14 56.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 75.42 110.918 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 60.53 17.81 7.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 74.55 110.865 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -132.43 -38.59 1.04 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 73.12 110.88 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.48 104.6 16.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 73.14 111.104 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -99.95 144.58 28.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 73.12 110.933 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -117.89 177.77 4.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 75.03 110.896 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.65 -15.31 17.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 74.32 110.919 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -166.06 172.13 11.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 75.5 110.933 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.6 -24.45 58.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.202 -0.454 . . . . 73.14 110.943 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.88 -56.94 14.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 71.11 110.904 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.95 -35.33 80.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 74.45 110.917 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.59 -52.4 63.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.463 . . . . 73.14 110.924 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.77 -36.63 76.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 75.52 111.099 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -55.51 -39.09 70.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 72.22 110.856 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -72.08 -44.18 63.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 74.34 110.857 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -67.91 -21.94 65.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.445 . . . . 63.01 110.929 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 63.0 m -84.57 -30.2 25.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.081 -0.508 . . . . 73.43 111.172 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 93.5 m -79.84 -24.01 41.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.191 -0.459 . . . . 75.42 111.18 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -163.15 159.54 23.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 72.33 110.835 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.25 -57.99 7.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 74.43 111.047 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 57.04 24.18 9.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.212 -0.449 . . . . 73.43 110.891 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 112.75 0.89 25.86 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.707 -0.759 . . . . 75.13 112.471 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -95.71 136.22 36.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.923 0.392 . . . . 65.14 110.922 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 49.3 t -51.82 -28.94 17.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.15 -0.477 . . . . 64.24 110.908 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.2 t -156.97 123.46 4.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.123 -0.489 . . . . 71.12 111.102 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -51.49 139.99 18.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.231 -0.44 . . . . 74.22 110.892 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 8.6 mt -62.32 135.81 57.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 73.42 110.946 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 29.3 mt -127.05 -51.4 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.431 . . . . 75.13 111.18 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -126.88 118.29 22.34 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.574 0.702 . . . . 74.44 110.881 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 138.15 37.15 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.757 2.305 . . . . 75.13 112.373 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 84.9 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 73.51 110.913 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 33.9 m -64.34 138.8 22.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 74.4 111.174 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.1 ptm . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 74.42 110.854 179.892 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.866 0.365 . . . . 75.41 110.919 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 28.4 t -92.47 88.65 6.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 73.34 110.856 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -71.62 147.69 47.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.47 . . . . 70.02 110.934 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.5 mtpp -154.0 129.46 9.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 73.53 110.921 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.61 175.3 5.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 71.43 110.887 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 41.8 mtt180 -63.7 -16.0 59.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 75.41 110.913 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.04 -42.12 98.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 74.03 110.903 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -103.12 -15.55 16.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 74.32 110.925 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -151.37 78.16 7.13 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.551 0.691 . . . . 75.11 110.801 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 -6.28 18.25 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.606 2.204 . . . . 74.54 112.326 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.7 t -93.4 27.23 2.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 74.32 111.096 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 36.8 mt -103.48 137.81 41.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.217 -0.447 . . . . 74.22 110.888 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.5 t -103.48 173.52 6.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 72.42 111.118 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.87 -35.23 22.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 74.31 110.838 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -63.28 -48.32 78.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.187 -0.461 . . . . 72.33 110.927 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -66.43 -52.27 48.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 74.11 110.897 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 45.8 mm -56.82 -45.75 83.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 63.42 111.12 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 32.6 p -72.5 -15.94 61.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 71.43 110.904 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -81.98 1.75 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.119 -0.491 . . . . 74.34 111.115 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 2.3 mtt . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 75.33 110.833 -179.941 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 27.3 t . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.897 0.379 . . . . 73.44 110.935 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 6.0 t 65.06 150.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.089 -0.505 . . . . 75.31 110.9 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 4.3 m -51.64 123.07 2.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.094 -0.503 . . . . 74.45 111.121 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -134.49 75.0 1.56 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.485 . . . . 75.12 110.875 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.1 mtmp? . . . . . 0 C--N 1.329 -0.299 0 CA-C-O 121.571 0.7 . . . . 73.13 110.857 179.911 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.465 -0.162 0 CA-C-O 120.763 0.235 . . . . 73.01 112.412 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 49.5 p-90 -54.89 -25.68 30.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 71.32 110.921 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -90.36 99.22 12.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 73.31 110.881 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -75.89 -40.69 53.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.119 -0.491 . . . . 72.35 110.778 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.83 24.84 54.91 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.732 -0.747 . . . . 73.43 112.512 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.79 65.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.815 0.34 . . . . 74.43 110.93 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.3 mm -129.73 144.21 38.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.145 -0.48 . . . . 72.43 111.081 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.77 177.17 5.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 75.1 111.175 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.3 ppt_? -64.59 -40.84 96.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.88 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -71.53 -34.74 70.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 74.42 110.869 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -73.29 -42.27 62.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 71.54 110.882 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.17 -33.81 63.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 74.4 111.098 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -62.2 -53.25 57.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 75.31 110.857 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -35.01 79.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.843 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 12.9 mt -59.09 -36.19 74.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.917 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -104.43 43.48 1.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 64.22 110.9 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.482 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.56 -59.98 5.22 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.675 0.75 . . . . 72.44 110.94 -179.999 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.482 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.5 Cg_endo -69.86 123.51 10.14 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.641 2.227 . . . . 74.53 112.311 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 117.35 5.03 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.608 2.206 . . . . 64.51 112.379 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -154.84 115.2 3.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 71.44 110.863 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.53 111.91 3.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 74.32 111.2 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.5 -6.47 6.26 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.695 -0.764 . . . . 72.31 112.452 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.6 tp -90.47 111.75 23.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.83 0.347 . . . . 72.55 110.936 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 22.3 p90 -124.43 163.66 21.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.462 . . . . 74.44 110.866 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -159.49 137.11 9.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.478 . . . . 74.31 110.902 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.2 t -110.22 137.89 40.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 75.13 111.157 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.71 145.76 26.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.148 -0.478 . . . . 73.13 110.938 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -51.9 124.22 12.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 72.32 110.881 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.7 m -58.31 110.96 1.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 71.42 110.81 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.8 m -68.82 -54.67 14.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 72.35 111.161 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -63.72 -27.92 69.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 72.31 110.859 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -123.14 95.28 46.05 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.659 0.742 . . . . 74.24 110.898 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 122.64 9.33 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.672 2.248 . . . . 73.33 112.364 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.49 -2.32 24.94 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.745 -0.741 . . . . 64.44 112.476 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -131.09 -175.94 3.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.856 0.36 . . . . 73.54 110.822 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -131.54 164.57 25.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.915 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.8 m -135.93 139.48 43.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 62.04 111.134 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.98 117.18 33.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.199 -0.455 . . . . 75.2 110.95 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.3 m -101.52 123.93 46.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.12 110.896 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.3 t -123.12 151.72 27.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 75.03 111.136 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -101.09 111.59 23.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 73.43 110.882 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.43 91.04 3.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.13 -0.486 . . . . 72.15 110.943 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 67.12 30.72 7.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 74.35 110.826 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.95 -14.83 62.4 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.822 -0.704 . . . . 72.31 112.505 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.3 ptpt -88.11 140.18 29.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.813 0.34 . . . . 72.11 110.885 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 8.6 m -99.94 108.9 23.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.253 -0.431 . . . . 74.33 111.085 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -95.9 121.8 38.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 71.55 110.929 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -99.73 124.67 45.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 72.54 110.892 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -111.13 117.23 32.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 74.54 110.92 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -67.64 132.29 47.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 71.35 110.871 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 55.1 mt -113.56 107.57 23.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 75.3 111.116 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.9 ttm -83.92 122.56 28.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.19 -0.459 . . . . 72.53 110.902 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -111.29 99.4 8.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 75.1 110.913 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -133.44 142.54 48.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 75.33 110.927 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 57.21 35.96 26.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.298 -0.41 . . . . 75.54 111.126 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.7 t 60.85 28.12 17.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 74.3 110.91 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.12 140.67 45.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 75.23 110.902 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.0 mp -102.2 147.65 26.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 72.52 110.911 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.95 137.66 5.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 54.23 110.828 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 51.0 mt -113.35 -31.93 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 74.35 111.152 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -90.52 1.2 56.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 75.23 110.894 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 60.62 17.81 7.81 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 60.5 110.899 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -132.43 -38.7 1.04 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 65.42 110.912 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.27 104.64 16.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 63.24 111.141 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -100.0 143.26 30.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 73.34 110.86 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -117.83 175.14 5.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 73.1 110.87 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.63 -1.91 34.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.505 . . . . 71.23 110.88 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -179.31 172.23 1.22 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 71.43 110.884 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.24 -28.18 59.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 70.42 110.925 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.0 ttt -58.03 -57.21 13.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 75.23 110.843 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -65.69 -37.31 86.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 73.44 110.944 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.43 -46.91 76.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 63.32 110.949 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 69.3 t -64.6 -39.47 85.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 75.44 111.152 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -54.83 -38.72 67.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.103 -0.498 . . . . 73.3 110.949 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.31 -45.43 63.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 74.13 110.887 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -67.22 -21.98 65.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 75.45 110.935 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 58.7 m -84.15 -29.95 26.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 73.33 111.139 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 86.4 m -78.13 -27.0 48.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.203 -0.453 . . . . 73.54 111.121 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -164.71 155.65 14.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.245 -0.434 . . . . 75.51 110.838 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.35 -58.2 6.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.135 -0.484 . . . . 75.11 111.092 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 52.51 28.97 6.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 72.25 110.873 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 121.89 -2.54 10.88 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.712 -0.756 . . . . 74.42 112.514 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 9.6 mp -101.62 136.45 41.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.786 0.327 . . . . 72.12 110.969 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 19.5 p -54.42 -26.72 32.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.169 -0.469 . . . . 73.14 110.894 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 9.0 t -157.31 125.09 5.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.103 -0.499 . . . . 70.1 111.126 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -51.96 164.99 0.23 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 75.34 110.845 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 11.5 mt -84.58 138.72 32.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 71.4 110.924 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 27.7 mt -127.22 -51.22 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 75.03 111.106 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -128.58 121.22 21.11 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.533 0.682 . . . . 74.24 110.935 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.84 136.99 34.19 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.633 2.222 . . . . 74.42 112.31 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.41 83.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 74.3 110.88 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 26.9 m -64.64 133.1 30.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 71.33 111.136 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 37.6 mtm . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 72.03 110.822 179.929 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.799 0.333 . . . . 75.53 110.876 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.25 88.83 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 70.32 110.837 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -72.61 146.9 46.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 75.25 110.904 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -140.82 129.23 22.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.081 -0.509 . . . . 74.35 110.822 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.31 156.21 17.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 75.45 110.856 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -59.17 -19.37 44.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.092 -0.504 . . . . 72.11 110.843 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.7 -39.5 88.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 74.42 110.867 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -96.2 -20.16 18.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.46 . . . . 71.43 111.017 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -147.34 77.77 10.51 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.596 0.712 . . . . 75.13 110.888 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -6.37 18.41 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.716 2.277 . . . . 71.24 112.349 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.2 t -93.79 27.45 2.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.249 -0.432 . . . . 65.04 111.167 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 42.1 mt -100.56 136.79 39.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 75.34 110.979 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.5 t -106.45 173.76 6.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 62.34 111.083 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -49.92 -37.45 31.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 74.41 110.89 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -60.87 -50.68 72.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 75.11 110.877 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -66.21 -52.04 51.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 71.34 110.907 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 44.7 mm -56.04 -53.5 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 73.44 111.092 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 20.1 m -64.18 -19.05 65.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 73.44 110.832 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.28 3.79 26.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.101 -0.5 . . . . 75.01 111.134 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 73.24 110.818 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.892 0.377 . . . . 73.12 110.88 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.34 155.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 70.42 110.866 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 4.3 m -51.74 120.54 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 75.44 111.145 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -135.43 74.66 1.52 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 75.4 110.955 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.596 0.712 . . . . 64.33 110.922 179.972 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.133 0 CA-C-O 120.773 0.239 . . . . 63.35 112.285 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 46.9 p-90 -54.44 -27.1 34.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.261 -0.427 . . . . 70.4 110.915 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -86.52 100.83 12.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 73.32 110.924 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -75.81 -39.42 56.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 74.33 110.894 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.28 22.7 45.06 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.787 -0.72 . . . . 53.22 112.495 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 pttt 179.01 68.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.717 0.294 . . . . 73.12 110.872 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 mm -133.7 144.21 36.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 74.21 111.138 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.23 177.03 5.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.472 . . . . 75.44 111.176 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -43.57 96.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 74.01 110.84 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.44 -32.52 72.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 74.14 110.897 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -75.61 -43.16 49.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.128 -0.487 . . . . 72.54 110.934 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.83 -33.57 64.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 64.21 111.129 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -63.34 -53.29 54.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 65.3 110.883 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.08 -34.92 79.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 73.44 110.849 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 13.5 mt -60.56 -35.78 76.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 74.41 110.974 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -102.32 43.55 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 71.32 110.861 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.481 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.24 -60.04 5.48 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.673 0.749 . . . . 73.13 110.917 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.82 123.17 9.82 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.727 2.284 . . . . 74.5 112.345 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 117.82 5.31 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.63 2.22 . . . . 74.25 112.396 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -154.81 104.79 2.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 71.41 110.916 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.2 p -57.98 111.92 1.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 74.13 111.165 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.05 -7.2 6.07 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.772 -0.728 . . . . 74.11 112.522 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.02 113.61 25.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.886 0.375 . . . . 75.41 110.899 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 27.0 p90 -125.22 165.2 18.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 75.1 110.853 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -161.54 137.28 7.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 74.31 110.939 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 89.0 t -110.19 142.88 21.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 74.12 111.132 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.96 148.83 25.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 74.4 110.855 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -52.08 124.21 12.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 73.35 110.916 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.2 m -59.81 117.31 4.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 72.33 110.928 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.3 m -69.12 -56.42 7.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.482 . . . . 61.04 111.146 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.96 -24.0 62.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 75.01 110.899 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -113.28 93.51 26.72 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.727 0.775 . . . . 74.32 110.94 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 111.07 2.7 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.721 2.28 . . . . 75.23 112.38 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.6 0.14 24.7 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.768 -0.73 . . . . 50.34 112.53 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -125.29 -175.88 3.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.797 0.332 . . . . 73.22 110.867 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -137.38 148.0 45.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 73.21 110.916 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 25.4 m -115.51 141.68 47.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.108 -0.496 . . . . 73.41 111.156 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -111.79 116.56 30.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 73.2 110.911 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.1 t -100.65 129.16 46.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 75.21 110.911 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.3 t -130.03 149.11 33.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 73.31 111.066 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.07 111.03 23.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 61.03 110.852 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.47 93.5 4.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 74.22 110.901 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 66.14 30.78 9.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.839 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.6 -14.3 63.29 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.73 -0.748 . . . . 74.22 112.536 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -88.08 147.5 24.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.756 0.312 . . . . 75.14 110.926 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 7.0 m -105.51 109.22 27.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 64.12 111.14 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -96.94 113.7 25.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 72.33 110.865 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -91.13 124.65 35.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 74.24 110.815 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -114.08 116.19 28.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.218 -0.446 . . . . 73.23 110.909 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.48 137.07 46.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.102 -0.499 . . . . 71.23 110.872 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 26.0 mt -119.7 109.62 26.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 74.5 111.113 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -81.3 124.72 29.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.272 -0.422 . . . . 74.11 110.902 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -111.67 98.29 7.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.307 -0.406 . . . . 75.22 110.937 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -132.06 142.57 49.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 72.4 110.897 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.18 35.97 26.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 74.44 111.073 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.38 26.6 16.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 71.4 110.84 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -131.93 139.14 48.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 74.35 110.894 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mp -102.42 149.86 23.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 73.3 110.922 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 29.2 t -166.19 140.96 4.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 61.12 110.814 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 52.2 mt -115.59 -32.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.048 -0.524 . . . . 74.24 111.173 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -89.7 1.05 56.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 72.12 110.92 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 60.41 18.18 7.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 71.0 110.795 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -132.29 -38.43 1.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 72.3 110.88 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.4 t -103.06 104.54 16.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 73.14 111.132 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -99.88 144.69 28.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 62.01 110.933 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -118.64 178.42 4.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 74.14 110.924 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -100.19 -16.22 17.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 75.23 110.917 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -164.81 171.65 13.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.111 -0.495 . . . . 73.11 110.874 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.63 -22.37 58.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 71.54 110.949 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.2 ttp -63.67 -56.96 11.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 74.22 110.876 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.82 -36.3 83.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.289 -0.414 . . . . 75.45 110.885 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.68 -47.58 76.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.198 -0.455 . . . . 73.53 110.916 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 70.7 t -65.29 -37.49 80.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 73.13 111.14 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -55.53 -38.76 69.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.134 -0.485 . . . . 74.34 110.926 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -45.29 61.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.891 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -67.5 -22.17 65.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 74.14 110.962 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 63.6 m -84.32 -29.62 26.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.105 -0.498 . . . . 74.03 111.088 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 92.6 m -78.13 -26.94 48.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 75.21 111.15 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.09 160.8 30.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 72.1 110.85 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.81 -58.28 6.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 71.33 111.068 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 6.0 t0 57.12 23.58 8.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 73.13 110.947 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.29 -0.64 25.2 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.721 -0.752 . . . . 32.42 112.498 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -93.28 140.08 29.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.942 0.401 . . . . 73.53 110.855 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 44.3 t -51.33 -30.37 18.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 72.21 110.871 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.8 t -158.96 127.34 5.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 70.33 111.137 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -51.35 140.59 16.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 71.4 110.868 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 8.6 mt -62.39 139.51 58.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 71.52 110.919 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 26.6 mt -126.94 -51.3 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.284 -0.416 . . . . 75.33 111.164 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -131.03 123.35 19.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.585 0.707 . . . . 75.31 110.951 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 135.43 30.44 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.711 2.274 . . . . 75.44 112.331 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.8 83.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.434 . . . . 75.22 110.886 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.7 m -64.32 136.8 25.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.296 -0.411 . . . . 72.12 111.165 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 72.25 110.824 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 1.7 mt . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.789 0.328 . . . . 72.43 110.868 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 40.0 t -84.83 88.68 7.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 73.23 110.832 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -76.08 149.61 37.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 74.35 110.972 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.57 129.17 17.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.117 -0.492 . . . . 65.43 110.932 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.13 163.05 13.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.286 -0.416 . . . . 63.22 110.862 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 10.6 mtt180 -63.8 -15.42 58.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 72.31 110.853 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -37.94 84.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 74.22 110.876 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -96.98 -14.96 21.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.107 -0.497 . . . . 65.33 110.794 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -156.39 80.75 3.7 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.577 0.703 . . . . 75.35 110.85 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -6.01 17.6 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.693 2.262 . . . . 65.04 112.341 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.2 t -93.61 27.26 2.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 72.23 111.188 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 34.7 mt -103.9 136.89 42.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 72.24 110.875 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 10.1 t -102.16 170.05 8.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.164 -0.471 . . . . 72.42 111.139 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -49.67 -33.89 16.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 65.11 110.919 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -62.5 -48.44 79.54 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.162 -0.472 . . . . 72.41 110.9 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -65.14 -51.72 59.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 73.41 110.92 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 27.4 mm -58.59 -53.77 42.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 75.15 111.089 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 26.8 t -58.01 -24.3 57.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 75.24 110.84 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -74.55 -5.67 44.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 62.14 111.069 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.256 -0.429 . . . . 74.15 110.879 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 3.9 t . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.791 0.329 . . . . 70.33 110.795 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.88 152.82 0.05 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 72.23 110.915 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 4.5 m -54.19 122.28 3.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.468 . . . . 73.41 111.096 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -132.95 74.88 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.069 -0.514 . . . . 74.1 110.919 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.352 0 CA-C-O 121.603 0.716 . . . . 63.1 110.932 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.694 0.206 . . . . 71.32 112.293 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 47.0 p-90 -54.82 -26.63 36.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 75.24 110.925 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -84.31 102.33 12.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 74.21 110.876 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 -76.39 -40.05 51.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 73.34 110.897 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.3 18.89 37.6 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.744 -0.741 . . . . 73.43 112.472 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -179.96 78.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.737 0.303 . . . . 74.31 110.864 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.5 mm -142.72 144.41 24.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 75.43 111.061 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.32 175.08 5.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.113 -0.494 . . . . 74.32 111.177 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.6 ttt180 -62.19 -42.71 99.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 75.15 110.883 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -68.34 -33.87 75.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.162 -0.472 . . . . 72.24 110.939 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -75.49 -41.78 54.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 74.32 110.922 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.48 -33.48 62.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.482 . . . . 71.11 111.129 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -63.4 -53.27 54.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.45 . . . . 75.33 110.922 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.18 -35.6 81.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.479 . . . . 75.24 110.832 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 16.7 mt -61.21 -35.82 78.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 71.31 110.892 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -102.96 43.12 1.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.19 -0.459 . . . . 75.31 110.878 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.479 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.18 -59.97 4.63 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.678 0.751 . . . . 72.04 110.907 179.996 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.9 Cg_endo -69.74 123.09 9.77 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.719 2.279 . . . . 74.53 112.323 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 118.21 5.54 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.665 2.243 . . . . 72.43 112.334 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -154.81 100.48 2.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.27 -0.423 . . . . 71.23 110.858 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.46 111.76 0.77 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 74.25 111.146 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.81 -6.28 6.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.79 -0.719 . . . . 73.15 112.504 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.28 111.75 23.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.808 0.337 . . . . 73.12 110.916 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -124.54 162.06 24.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 73.31 110.89 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -158.37 138.67 12.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 73.4 110.873 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 79.9 t -110.16 137.73 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 75.3 111.145 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -149.8 143.39 25.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.212 -0.449 . . . . 75.54 110.882 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -50.24 123.78 9.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.447 . . . . 75.53 110.823 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 m -57.56 115.79 2.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.456 . . . . 75.35 110.86 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.2 m -68.57 -56.39 8.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 70.02 111.133 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -69.28 -26.62 64.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 71.43 110.921 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -112.28 94.46 26.62 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.632 0.729 . . . . 71.11 110.939 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 112.26 3.03 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.663 2.242 . . . . 73.31 112.384 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.77 3.29 23.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.743 -0.741 . . . . 74.33 112.434 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -131.05 -176.06 3.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.816 0.341 . . . . 72.11 110.907 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -131.67 165.58 23.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 74.31 110.929 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 99.1 m -126.56 141.61 51.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.086 -0.506 . . . . 73.43 111.184 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.16 106.32 16.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.279 -0.418 . . . . 75.33 110.885 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.6 m -98.99 118.69 36.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.47 . . . . 74.12 110.911 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.4 t -124.36 150.41 29.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 72.23 111.045 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.95 112.36 25.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 71.45 110.941 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.6 97.58 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.07 -0.514 . . . . 72.33 110.849 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 65.74 27.61 11.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.884 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.75 -13.38 63.92 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.752 -0.737 . . . . 72.23 112.498 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -88.38 140.3 29.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.764 0.316 . . . . 70.45 110.936 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 11.2 m -100.47 111.37 29.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 72.44 111.13 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -99.68 124.84 45.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.89 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 61.1 m-70 -103.39 124.0 47.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 74.33 110.873 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -114.67 100.24 8.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 74.21 110.964 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -55.54 131.76 46.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 74.34 110.834 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 38.2 mt -110.45 109.63 29.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 72.42 111.133 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.76 129.08 34.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.35 110.924 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -114.97 100.71 8.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.271 -0.422 . . . . 72.11 110.974 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -134.68 142.43 46.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 74.43 110.913 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 57.38 36.13 26.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 63.41 111.058 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.7 t 61.04 27.46 17.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 74.14 110.858 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 2.7 mtmm -133.21 145.34 50.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.136 -0.484 . . . . 75.41 110.82 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.6 mp -106.22 150.8 25.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 72.42 110.909 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.9 t -169.62 140.8 2.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 74.12 110.862 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 59.7 mt -115.51 -26.19 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 61.45 111.175 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 5.9 p30 -96.67 -2.48 44.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 60.14 110.884 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 61.94 16.75 8.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 63.02 110.882 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -127.36 -34.07 2.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 72.33 110.894 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.4 t -111.86 104.75 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 75.51 111.127 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -98.33 143.44 28.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.47 . . . . 75.33 110.931 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -117.51 171.53 7.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.083 -0.508 . . . . 74.11 110.862 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.68 -18.95 24.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.193 -0.458 . . . . 75.53 110.861 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -171.24 158.84 5.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 75.2 110.905 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 2.4 mp -51.36 -36.88 45.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 74.23 110.961 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.4 ttp -51.87 -48.87 63.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 74.5 110.939 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -68.99 -41.67 77.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 71.45 110.943 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.0 -50.55 70.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 62.41 110.906 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 91.4 t -59.02 -43.67 89.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 74.24 111.141 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.78 -39.51 71.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 72.32 110.896 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.75 -50.74 48.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 72.31 110.842 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -65.46 -19.63 66.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.469 . . . . 74.2 110.934 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 97.3 m -84.24 -28.77 27.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.13 -0.486 . . . . 74.31 111.041 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 27.2 m -81.92 -24.4 35.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.331 -0.395 . . . . 71.33 111.148 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -161.7 162.25 29.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 64.15 110.874 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.46 -58.1 7.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.207 -0.451 . . . . 74.24 111.0 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.76 20.5 10.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 75.42 110.911 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 112.3 13.53 11.83 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 75.4 112.483 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.6 mp -108.75 138.41 45.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.85 0.357 . . . . 75.23 110.936 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 31.6 t -51.66 -31.17 24.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.901 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 7.2 t -153.99 124.17 6.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.141 -0.481 . . . . 62.01 111.15 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -51.88 156.08 1.59 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 75.1 110.845 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.7 mt -72.51 134.93 45.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 74.13 110.947 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 24.6 mt -127.03 -51.11 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.191 -0.459 . . . . 75.32 111.179 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -127.55 121.13 22.18 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.534 0.683 . . . . 74.1 110.866 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 135.13 29.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.694 2.263 . . . . 74.11 112.349 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.66 84.04 0.44 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 73.51 110.914 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 22.0 t -64.42 131.42 30.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 72.31 111.099 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 33.3 mtp . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 75.43 110.881 179.91 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.812 0.339 . . . . 74.22 110.888 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 2.2 m -113.59 89.03 2.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 71.4 110.866 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -72.32 148.26 45.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.51 . . . . 75.23 110.896 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -143.12 129.08 19.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.089 -0.505 . . . . 74.53 110.879 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.04 158.77 16.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.232 -0.44 . . . . 72.14 110.781 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -59.76 -19.01 47.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 73.43 110.817 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -37.2 86.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 71.4 110.887 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -96.59 -17.6 20.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 74.44 110.872 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -155.05 79.92 4.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.583 0.706 . . . . 71.22 110.843 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -5.69 16.79 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.654 2.236 . . . . 62.1 112.353 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.4 t -92.68 27.53 2.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 73.42 111.132 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 23.8 mt -102.01 136.79 41.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.424 . . . . 72.33 110.922 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 12.1 t -105.98 174.84 5.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 74.4 111.151 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -49.6 -37.97 29.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 73.41 110.868 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.61 -51.83 66.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.149 -0.478 . . . . 74.23 110.846 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -63.43 -52.08 63.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 74.05 110.909 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 43.1 mm -56.83 -53.78 37.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 75.41 111.1 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 26.3 t -58.85 -22.44 58.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.441 . . . . 74.43 110.868 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.53 4.13 25.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 74.34 111.065 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.863 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 CA--C 1.526 0.058 0 CA-C-O 120.959 0.409 . . . . 72.45 110.903 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 64.74 153.66 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.049 -0.523 . . . . 71.25 110.822 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 4.6 m -52.56 126.34 8.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.097 -0.501 . . . . 74.35 111.135 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -136.61 77.47 1.65 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 75.42 110.939 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? . . . . . 0 C--N 1.33 -0.277 0 CA-C-O 121.511 0.672 . . . . 75.01 110.95 179.914 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 N--CA 1.466 -0.113 0 CA-C-O 120.829 0.262 . . . . 73.13 112.402 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 35.1 p-90 -101.25 -29.41 12.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 74.35 110.897 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -90.3 106.58 18.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.278 -0.419 . . . . 75.15 110.939 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -83.63 -41.81 17.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 75.44 110.839 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 52.14 34.48 39.77 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.703 -0.761 . . . . 72.52 112.477 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.17 34.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.776 0.322 . . . . 74.23 110.864 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.7 mm -102.69 144.2 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 74.22 111.153 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.06 157.43 17.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 75.1 111.108 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.3 ppt_? -52.94 -36.95 60.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 74.41 110.896 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.2 -32.08 55.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 75.22 110.886 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -72.88 -35.23 67.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 74.13 110.929 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.99 -34.78 59.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 70.24 111.092 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -63.3 -52.69 60.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 72.24 110.863 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -39.51 94.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 71.43 110.811 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.3 mt -54.99 -39.34 68.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.276 -0.42 . . . . 73.41 110.943 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -99.01 43.38 1.06 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.904 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.481 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.42 -59.92 5.43 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.711 0.767 . . . . 74.44 110.926 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.69 123.41 10.1 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.719 2.279 . . . . 75.11 112.418 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 117.53 5.13 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.659 2.239 . . . . 75.54 112.379 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -154.75 112.34 3.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.455 . . . . 70.43 110.965 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.92 111.73 2.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.466 . . . . 70.12 111.209 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.95 -6.2 6.1 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.713 -0.756 . . . . 42.44 112.463 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.94 113.99 26.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.824 0.345 . . . . 72.1 110.922 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 18.9 p90 -125.55 166.09 17.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.141 -0.481 . . . . 72.01 110.863 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -163.93 138.33 5.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.151 -0.477 . . . . 72.33 110.907 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 90.5 t -110.37 128.22 66.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 75.55 111.141 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 145.13 42.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 75.33 110.821 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.62 127.15 19.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 63.3 110.864 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.8 m -61.82 113.34 2.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 73.15 110.87 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.8 m -69.31 -55.99 8.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.487 . . . . 73.02 111.083 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -63.57 -28.97 70.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 75.22 110.888 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.403 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 33.8 m-85 -119.76 96.94 49.76 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.757 0.789 . . . . 74.04 110.94 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.7 Cg_endo -69.77 119.15 6.15 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.672 2.248 . . . . 71.42 112.375 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.73 -12.82 22.76 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.727 . . . . 73.4 112.499 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -114.26 -178.55 3.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.807 0.337 . . . . 75.03 110.85 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -131.05 160.21 35.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 71.05 110.964 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 58.8 m -133.36 131.85 40.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 73.55 111.12 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -100.98 121.39 41.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 72.41 110.836 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.3 m -105.36 126.18 51.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.109 -0.496 . . . . 72.0 110.918 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.1 t -126.0 151.89 32.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.174 -0.466 . . . . 74.43 111.079 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.47 111.72 24.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 73.34 110.874 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.7 93.27 4.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.143 -0.481 . . . . 63.25 110.839 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 66.19 29.72 9.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 71.32 110.962 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.99 -13.42 63.54 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.715 -0.755 . . . . 63.11 112.525 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.2 ptpt -88.3 139.25 30.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.33 . . . . 72.42 110.884 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.0 t -99.66 104.69 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 71.04 111.169 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -92.81 122.06 34.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 73.25 110.918 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -100.84 124.85 47.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.13 -0.486 . . . . 72.41 110.85 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -111.9 118.69 36.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.22 -0.445 . . . . 71.02 110.937 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -68.16 134.99 51.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 75.52 110.87 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 53.2 mt -117.59 109.59 28.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.476 . . . . 74.02 111.15 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.8 129.18 34.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 73.12 110.894 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -114.64 98.99 7.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 72.21 110.89 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -130.94 142.44 50.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 73.51 110.908 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.12 36.77 27.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 73.13 111.07 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.26 23.95 14.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 73.2 110.817 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 3.8 mtmt -128.93 140.48 51.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.164 -0.471 . . . . 72.53 110.947 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 mp -101.73 151.93 21.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 72.54 110.945 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 39.6 t -168.43 142.22 3.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.874 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 52.6 mt -115.54 -40.83 3.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 72.32 111.125 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 38.1 p-10 -88.0 -1.04 57.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 70.1 110.93 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 59.6 20.04 8.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 71.1 110.877 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -123.23 -35.61 2.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 65.12 110.779 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.6 p -119.11 105.02 16.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 71.44 111.056 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -92.92 153.93 18.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 75.45 110.896 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -124.3 174.23 7.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 73.23 110.936 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.76 -17.91 21.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.01 110.849 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -171.82 158.85 5.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.478 . . . . 63.23 110.899 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.86 -36.02 46.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 72.12 110.9 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 2.6 ttt -53.03 -49.55 66.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 73.34 110.946 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -67.84 -39.69 83.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 71.43 110.948 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.9 -51.63 66.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 73.3 110.928 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 98.8 t -59.72 -42.85 90.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.23 111.078 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -54.39 -37.77 65.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 72.12 110.831 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -50.42 28.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 70.12 110.813 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -66.49 -14.6 62.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 75.32 110.895 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 81.7 m -88.73 -32.35 17.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 74.4 111.119 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.9 m -80.27 -22.55 41.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 62.13 111.19 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -161.89 161.96 29.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 73.43 110.892 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.94 -58.07 6.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 75.53 111.124 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.87 18.45 10.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.468 . . . . 74.21 110.836 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.57 3.59 27.05 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.701 -0.761 . . . . 65.2 112.484 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 7.2 mp -95.61 138.63 33.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.85 0.357 . . . . 75.21 110.986 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 41.0 t -51.52 -29.87 18.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 73.53 110.948 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.7 t -156.17 122.76 5.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 74.4 111.101 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -51.28 147.36 5.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 70.13 110.898 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 6.8 mt -65.78 133.86 51.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 73.52 110.987 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 28.1 mt -127.12 -51.32 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 74.32 111.153 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -126.67 118.38 22.71 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.481 0.657 . . . . 75.23 110.961 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.68 139.95 41.79 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.689 2.26 . . . . 73.31 112.36 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.07 82.94 0.51 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 74.31 110.912 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 15.8 m -64.81 125.99 22.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.278 -0.419 . . . . 75.44 111.171 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 30.3 mtp . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 72.54 110.847 179.969 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.526 0.041 0 CA-C-O 120.857 0.36 . . . . 75.3 110.868 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 12.2 t -119.99 88.33 2.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 75.35 110.912 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -75.09 149.25 39.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 64.25 110.881 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.98 129.14 19.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.097 -0.501 . . . . 65.31 110.911 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.42 163.62 14.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 73.44 110.851 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -64.06 -14.98 58.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.074 -0.512 . . . . 74.34 110.86 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -37.34 79.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 73.1 110.86 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -98.11 -18.21 18.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.103 -0.499 . . . . 74.1 110.893 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -151.47 78.06 7.1 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.65 0.738 . . . . 75.24 110.923 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -5.95 17.39 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.681 2.254 . . . . 73.32 112.382 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.6 t -93.32 27.5 2.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.113 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 31.3 mt -101.45 136.82 40.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 72.23 110.894 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.5 t -106.03 173.55 6.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 74.13 111.09 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -49.4 -37.77 26.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 75.54 110.873 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -60.91 -53.02 62.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 53.23 110.912 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -62.93 -52.44 63.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.195 -0.457 . . . . 74.54 110.91 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 41.9 mm -55.9 -53.92 32.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.11 -0.496 . . . . 75.4 111.154 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 60.5 p -58.71 -21.8 55.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 75.42 110.86 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.23 4.09 24.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 71.51 111.101 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.9 mtm . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.458 . . . . 73.12 110.935 179.919 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 11.6 t . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.803 0.335 . . . . 65.21 110.779 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.77 132.67 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.465 . . . . 63.55 110.806 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 20.7 m -52.47 125.64 6.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.042 -0.527 . . . . 73.23 111.13 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -130.59 76.34 1.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 75.31 110.841 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 30.4 mttt . . . . . 0 C--N 1.329 -0.297 0 CA-C-O 121.601 0.715 . . . . 74.3 110.859 179.87 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 N--CA 1.465 -0.179 0 CA-C-O 120.767 0.236 . . . . 73.05 112.347 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 42.9 p-90 -99.98 -29.81 12.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.221 -0.445 . . . . 74.42 110.832 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -85.78 99.3 11.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.261 -0.427 . . . . 65.34 110.895 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.88 -37.0 59.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 73.33 110.796 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.61 19.61 35.52 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.722 -0.752 . . . . 62.34 112.509 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.65 80.51 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.7 0.286 . . . . 73.22 110.82 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 27.2 mm -145.12 144.99 21.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.277 -0.419 . . . . 64.21 111.175 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.3 p -100.38 177.09 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.214 -0.448 . . . . 71.14 111.216 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 64.1 ttt-85 -63.75 -41.22 98.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 71.42 110.858 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.36 -36.79 83.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.435 . . . . 74.45 110.914 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.25 -39.8 59.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 71.32 110.969 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.46 -33.94 65.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 71.41 111.074 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -65.0 -53.34 47.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.445 . . . . 72.24 110.887 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -35.55 81.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.46 . . . . 74.23 110.891 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.55 -35.43 77.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 74.14 110.926 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -105.48 43.38 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.11 110.951 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.476 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.98 -60.21 4.56 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.748 0.785 . . . . 62.54 110.933 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.3 Cg_endo -69.79 123.64 10.29 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.663 2.242 . . . . 73.23 112.343 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.8 117.57 5.16 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.717 2.278 . . . . 71.24 112.392 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -154.72 110.3 3.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.889 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.1 p -61.98 111.88 2.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 75.02 111.114 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.68 -6.88 6.2 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 73.13 112.491 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.7 tp -90.72 111.79 23.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.855 0.36 . . . . 74.1 110.859 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 18.9 p90 -123.12 167.63 13.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 73.42 110.879 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -163.39 137.13 5.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.114 -0.494 . . . . 73.21 110.883 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 90.1 t -110.4 135.16 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 74.35 111.143 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -149.1 140.51 23.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 73.43 110.888 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -50.96 124.01 10.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.437 . . . . 75.44 110.857 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.7 t -55.44 119.38 5.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 73.24 110.866 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 94.1 m -70.15 -56.15 7.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 71.12 111.111 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -63.42 -42.64 98.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.255 -0.43 . . . . 70.14 110.871 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -106.01 96.08 12.24 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.621 0.724 . . . . 74.42 110.923 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 122.21 8.88 Favored 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 122.647 2.232 . . . . 74.23 112.342 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.75 -9.64 23.57 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.757 -0.735 . . . . 74.23 112.479 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -118.64 176.89 5.05 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.768 0.318 . . . . 70.11 110.925 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -124.13 158.68 31.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.285 -0.416 . . . . 74.11 110.93 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.5 m -132.19 121.67 24.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 74.53 111.194 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.01 116.84 29.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 73.24 110.916 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 1.8 t -102.33 125.53 49.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.278 -0.419 . . . . 64.34 110.811 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.1 t -125.68 151.39 31.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 63.12 111.141 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.06 112.07 24.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.476 . . . . 75.53 110.843 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.55 94.36 4.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 75.23 110.904 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 66.56 29.15 9.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.33 110.925 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 98.0 -14.3 62.79 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.7 -0.762 . . . . 72.12 112.523 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.88 139.65 30.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.806 0.336 . . . . 71.33 110.973 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 6.2 m -98.84 99.68 9.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.289 -0.414 . . . . 75.11 111.157 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -86.67 123.75 32.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 73.24 110.915 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 53.6 m-70 -101.38 127.15 48.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.118 -0.492 . . . . 75.15 110.946 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -113.48 106.23 14.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 71.43 110.933 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -58.26 137.25 57.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 73.53 110.902 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 61.8 mt -117.97 107.31 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 75.35 111.163 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.77 126.68 31.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 73.33 110.874 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -113.88 114.62 26.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.456 . . . . 74.43 110.936 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -149.72 138.37 20.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.137 -0.483 . . . . 74.23 110.922 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 53.66 35.83 22.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 64.41 111.094 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.72 28.81 16.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 63.53 110.863 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -129.36 140.1 51.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 74.35 110.847 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.8 mp -105.51 147.22 28.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 65.14 110.883 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 28.0 t -164.45 139.17 5.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 75.01 110.874 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 46.2 mt -115.53 -40.85 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.145 -0.48 . . . . 74.05 111.152 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -83.86 -7.02 59.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 71.34 110.882 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 61.79 16.12 7.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.187 -0.46 . . . . 73.4 110.889 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -123.23 -11.29 7.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 71.03 110.916 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -143.07 104.36 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.156 -0.474 . . . . 75.1 111.118 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -92.58 144.68 25.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.23 110.885 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -115.17 175.37 5.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.096 -0.502 . . . . 75.03 110.868 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.34 -13.92 18.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 54.11 110.932 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -168.7 171.84 8.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 65.11 110.883 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 mp -73.87 -24.02 59.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 70.32 110.908 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -59.6 -56.89 16.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 74.51 110.889 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -68.08 -36.5 79.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 72.11 110.885 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.47 -52.98 61.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.245 -0.434 . . . . 74.11 110.968 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 56.9 t -62.61 -36.22 74.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.116 -0.493 . . . . 74.32 111.133 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -55.33 -39.49 70.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 74.45 110.883 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -71.89 -50.3 30.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 74.25 110.838 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -62.71 -22.32 66.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 74.04 110.95 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 89.1 m -86.38 -27.13 24.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 72.13 111.166 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 90.0 m -79.4 -23.66 43.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 74.4 111.095 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.76 165.45 23.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.249 -0.432 . . . . 64.24 110.892 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.27 -58.3 6.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.46 . . . . 74.53 111.101 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 58.65 21.38 8.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.119 -0.491 . . . . 70.34 110.814 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 106.75 16.69 13.39 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.692 -0.766 . . . . 75.33 112.465 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.6 mp -107.3 140.31 40.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.833 0.349 . . . . 73.41 110.933 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 48.6 t -51.78 -29.89 20.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 73.2 110.912 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.7 t -159.4 123.58 3.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 75.54 111.176 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.96 146.16 6.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 73.12 110.884 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.3 mt -65.0 136.68 57.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 75.22 110.903 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 28.1 mt -127.06 -51.23 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.273 -0.421 . . . . 72.24 111.167 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.21 119.63 19.73 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.659 0.742 . . . . 74.43 110.851 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 140.76 43.39 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.73 2.287 . . . . 71.23 112.361 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.67 82.72 0.61 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 72.53 110.891 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 26.8 m -64.89 129.03 28.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.411 . . . . 64.2 111.079 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.9 ptm . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 72.12 110.853 179.912 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.893 0.378 . . . . 72.21 110.911 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 9.4 t -123.03 88.07 2.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 74.41 110.795 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -76.19 149.06 37.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.107 -0.497 . . . . 73.55 110.937 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -158.2 129.73 6.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 74.45 110.884 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.13 175.83 5.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.245 -0.434 . . . . 62.41 110.873 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 26.5 mtt180 -64.48 -15.67 61.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 73.01 110.864 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -41.83 99.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 71.13 110.906 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -104.2 -10.38 17.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.099 -0.5 . . . . 62.44 110.937 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -158.15 78.6 3.33 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.598 0.713 . . . . 75.51 110.872 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -6.12 17.81 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.697 2.264 . . . . 61.25 112.344 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.9 t -93.18 27.18 2.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.246 -0.434 . . . . 73.4 111.102 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 31.2 mt -105.1 137.97 42.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.436 . . . . 72.13 110.894 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.5 t -103.66 173.46 6.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 72.22 111.209 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -50.33 -32.83 18.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 73.42 110.918 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.83 -47.64 74.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 64.12 110.855 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -67.42 -52.35 40.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 75.13 110.904 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 46.0 mm -55.94 -46.79 80.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 70.23 111.152 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 27.9 p -72.06 -17.03 62.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.855 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.39 2.42 32.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 65.22 111.17 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 65.54 110.902 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.859 0.362 . . . . 74.12 110.849 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 65.15 151.05 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 72.42 110.874 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 6.7 m -51.47 122.58 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 74.2 111.132 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -135.26 76.7 1.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 75.22 110.927 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? . . . . . 0 C--N 1.329 -0.317 0 CA-C-O 121.618 0.723 . . . . 73.21 110.877 179.934 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 C--O 1.231 0.172 0 CA-C-O 120.796 0.248 . . . . 62.41 112.378 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -101.94 -29.37 11.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 75.43 110.898 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -85.59 99.56 11.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 75.13 110.818 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -75.88 -38.77 57.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 71.31 110.831 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.34 20.66 45.25 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.736 -0.745 . . . . 42.12 112.502 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 179.38 66.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 75.22 110.932 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.3 mm -129.58 144.74 37.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.443 . . . . 75.41 111.106 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.33 176.98 5.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.19 -0.459 . . . . 73.21 111.144 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -38.25 86.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 74.51 110.858 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.87 -33.63 62.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.445 . . . . 63.45 110.847 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -73.54 -41.33 63.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.24 110.832 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.32 -33.65 61.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 74.52 111.097 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -62.16 -53.47 54.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 73.23 110.863 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -38.49 91.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.12 110.892 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.5 mt -54.99 -38.91 68.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.181 -0.463 . . . . 75.51 110.905 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -101.26 43.7 1.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 72.31 110.892 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.487 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -66.89 -59.46 7.72 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.656 0.741 . . . . 72.44 110.978 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.81 123.11 9.76 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.697 2.264 . . . . 74.5 112.312 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 119.1 6.1 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.683 2.255 . . . . 73.52 112.34 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -155.09 108.99 2.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 74.31 110.95 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -60.92 117.17 5.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 64.31 111.153 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 123.83 -6.49 8.96 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.734 -0.746 . . . . 72.51 112.493 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 tp -91.2 116.02 28.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 70.43 110.869 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 14.9 p90 -128.25 163.38 24.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 74.24 110.866 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.1 pp -161.18 134.83 6.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.494 . . . . 74.23 110.886 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 87.0 t -109.65 136.03 46.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 73.43 111.133 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -147.13 144.24 28.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 74.34 110.874 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -51.66 124.19 11.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.471 . . . . 75.1 110.88 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 m -57.22 116.05 3.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 63.03 110.806 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 78.8 m -69.31 -56.39 7.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.103 -0.499 . . . . 73.44 111.115 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 21.3 p30 -71.7 -26.57 62.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.238 -0.437 . . . . 72.23 110.866 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.71 90.24 7.23 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.768 0.794 . . . . 73.23 110.886 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 112.32 3.05 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.671 2.247 . . . . 75.12 112.336 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.58 6.0 21.95 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.718 -0.753 . . . . 54.41 112.502 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -136.16 178.76 6.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.829 0.347 . . . . 71.25 110.871 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 99.2 m-85 -128.58 160.48 32.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.446 . . . . 75.13 110.948 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 93.4 m -131.68 140.27 49.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 52.44 111.137 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.13 120.59 42.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 72.53 110.859 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 3.8 t -103.36 126.19 50.39 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.144 -0.48 . . . . 75.05 110.923 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.3 t -128.06 146.3 33.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.1 111.107 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.41 110.43 22.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 61.14 110.896 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.49 94.05 4.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.135 -0.484 . . . . 73.34 110.913 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 66.92 28.81 8.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 74.22 110.828 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.75 -16.22 60.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.732 -0.747 . . . . 44.13 112.503 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -87.99 139.78 30.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.839 0.352 . . . . 75.32 110.888 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 11.4 m -98.06 110.3 25.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 75.13 111.117 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -97.03 113.62 25.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 72.52 110.828 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -90.77 124.76 35.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 65.23 110.848 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -115.54 108.93 17.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 71.22 110.935 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.02 142.54 58.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.14 -0.482 . . . . 73.55 110.834 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 30.8 mt -122.59 111.66 31.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.215 -0.448 . . . . 74.35 111.152 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -84.1 130.11 34.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 72.23 110.833 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -114.32 100.75 8.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 73.25 110.92 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -134.4 142.57 47.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 74.15 110.852 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.9 37.69 28.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.129 -0.487 . . . . 64.0 111.08 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.73 31.59 21.33 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.983 0.421 . . . . 71.13 110.89 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 4.0 mtmm -138.41 143.34 39.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.099 -0.5 . . . . 74.51 110.83 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.4 mp -104.25 151.67 23.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.25 110.953 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -169.4 144.99 3.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.238 -0.437 . . . . 75.22 110.839 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 47.8 mt -115.61 -37.83 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.103 -0.499 . . . . 74.13 111.122 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -88.77 -0.3 57.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 72.43 110.896 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 60.93 17.35 7.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.23 -0.441 . . . . 73.42 110.905 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -125.27 -32.48 2.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 73.42 110.864 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -113.65 104.62 17.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 71.51 111.081 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -97.74 143.86 27.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 74.34 110.97 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -119.06 175.18 5.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.05 -0.523 . . . . 74.23 110.886 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.05 -16.38 20.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 74.34 110.912 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -172.49 159.71 4.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 65.53 110.895 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.21 -39.19 59.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 71.3 110.978 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.8 ttt -51.03 -49.74 59.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.872 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -66.93 -39.85 87.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 73.24 110.941 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.07 -50.69 71.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 75.51 110.912 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 96.8 t -57.95 -44.24 86.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 74.11 111.108 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -53.27 -40.17 64.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 73.11 110.954 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -52.96 17.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.17 -0.468 . . . . 73.44 110.894 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -62.27 -17.48 58.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 72.11 110.893 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 80.9 m -85.91 -32.81 21.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 64.33 111.152 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 3.2 m -82.12 -16.3 50.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 75.04 111.154 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -177.38 131.85 0.17 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 74.41 110.872 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.3 -58.45 5.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 74.25 111.077 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 50.86 37.93 18.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 74.23 110.855 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 129.76 0.45 5.67 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.728 -0.748 . . . . 71.32 112.461 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -106.73 139.58 40.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.835 0.35 . . . . 74.11 110.975 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 53.7 t -56.79 -21.72 30.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 74.15 110.893 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.8 t -162.2 116.36 1.84 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.143 -0.48 . . . . 71.21 111.119 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.41 138.02 13.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 73.34 110.864 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 8.4 mt -61.34 126.71 28.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.441 . . . . 75.44 110.848 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 51.3 mt -109.71 -51.49 6.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 75.4 111.112 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? -136.77 139.71 29.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.562 0.696 . . . . 75.14 110.858 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.82 139.46 40.08 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.631 2.221 . . . . 65.54 112.276 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.54 84.3 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 74.12 110.885 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 29.2 m -63.95 131.01 29.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 65.14 111.106 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.5 ptt? . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 64.34 110.923 179.841 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.821 0.343 . . . . 73.31 110.889 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 10.3 t -101.71 87.87 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 71.4 110.902 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -83.53 119.53 24.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 74.22 110.863 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -120.72 128.52 53.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 75.22 110.939 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.22 172.63 8.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 75.34 110.913 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 51.3 mtt180 -62.52 -16.41 55.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 74.44 110.838 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -37.78 84.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 64.01 110.893 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -104.01 -23.9 13.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 73.52 110.854 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -143.28 78.89 14.57 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.619 0.723 . . . . 73.32 110.857 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -6.16 17.94 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.663 2.242 . . . . 70.21 112.35 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.7 t -93.64 27.58 2.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 71.04 111.119 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 36.8 mt -100.7 147.73 25.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 72.32 110.979 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.3 t -113.31 173.77 6.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 74.44 111.122 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -48.81 -36.91 17.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.204 -0.453 . . . . 72.32 110.9 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -62.45 -49.89 73.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 74.22 110.9 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -64.12 -48.72 75.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 73.4 110.834 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 42.5 mm -61.94 -35.65 69.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 73.14 111.111 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 10.8 t -77.51 -15.71 59.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 64.34 110.813 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.41 3.62 27.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.135 -0.484 . . . . 74.23 111.082 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 75.11 110.904 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.938 0.399 . . . . 72.34 110.845 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 64.16 156.77 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 74.31 110.818 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 6.0 m -50.86 118.62 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 74.13 111.092 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -136.75 85.34 2.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.471 . . . . 72.33 110.866 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 14.6 mttt . . . . . 0 C--N 1.329 -0.313 0 CA-C-O 121.519 0.676 . . . . 71.25 110.94 179.892 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 C--O 1.231 0.174 0 CA-C-O 120.707 0.211 . . . . 54.21 112.334 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 56.1 p-90 -81.88 -18.79 42.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.218 -0.446 . . . . 74.34 110.911 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -97.59 99.28 10.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.44 . . . . 74.51 110.889 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -75.99 -39.48 55.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 73.31 110.871 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 56.84 22.25 40.3 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 75.45 112.508 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.21 69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.773 0.32 . . . . 61.34 110.886 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 11.6 mm -133.12 144.44 36.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 74.22 111.125 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.18 168.89 9.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.15 -0.477 . . . . 73.01 111.105 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -58.93 -39.49 81.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.9 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -71.37 -35.62 71.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 74.02 110.963 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -72.93 -40.47 65.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.072 -0.513 . . . . 73.53 110.96 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.63 -33.74 60.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 73.04 111.138 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -61.67 -53.09 60.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.244 -0.434 . . . . 75.53 110.845 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -38.21 90.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.89 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.1 mt -55.62 -38.07 69.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.479 . . . . 73.43 110.967 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -100.0 43.27 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 73.44 110.933 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.486 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.62 -59.87 5.27 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.686 0.755 . . . . 63.13 110.942 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.2 Cg_endo -69.77 123.56 10.22 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.705 2.27 . . . . 73.03 112.332 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 116.87 4.76 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.719 2.28 . . . . 71.31 112.37 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -154.98 109.33 2.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 72.11 110.9 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.09 111.64 2.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 73.5 111.164 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 131.03 -9.21 5.71 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.797 -0.716 . . . . 60.32 112.514 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -87.32 111.65 21.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.873 0.368 . . . . 74.32 110.885 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -123.59 163.63 20.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 74.22 110.908 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -160.45 135.74 7.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.16 -0.473 . . . . 72.44 110.917 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 87.8 t -109.97 137.04 44.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.236 -0.438 . . . . 74.54 111.063 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.7 ptt180 -150.15 144.4 25.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 73.32 110.867 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -54.9 125.71 21.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.484 . . . . 62.02 110.863 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.96 116.57 2.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 74.35 110.795 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.5 m -69.95 -29.88 67.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 75.2 111.111 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -102.53 0.35 33.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 73.53 110.881 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.402 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -139.7 94.88 9.04 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.657 0.742 . . . . 71.2 110.965 -179.925 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.7 Cg_endo -69.79 113.02 3.24 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.673 2.249 . . . . 75.52 112.354 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.8 -8.87 23.64 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.718 -0.753 . . . . 64.05 112.418 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.09 163.97 15.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.833 0.349 . . . . 75.11 110.87 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -118.32 160.08 22.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 71.41 110.953 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.6 m -137.02 127.94 27.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 73.14 111.141 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.58 125.06 46.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 73.42 110.973 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 17.9 t -109.24 124.26 50.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.225 -0.443 . . . . 71.34 110.899 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.1 t -123.5 153.39 29.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.471 . . . . 75.1 111.121 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -104.93 112.49 25.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 44.31 110.879 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.78 94.59 4.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.457 . . . . 54.45 110.926 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 67.16 29.67 7.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 70.41 110.971 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.74 -14.1 63.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.747 -0.739 . . . . 74.1 112.514 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.69 141.05 28.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 74.11 110.876 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 9.0 m -100.83 111.1 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 74.54 111.149 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -102.23 123.97 46.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 74.1 110.854 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -101.15 132.18 46.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 75.22 110.902 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -116.17 122.73 45.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 71.44 110.921 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -72.17 136.02 46.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 74.41 110.909 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 54.1 mt -117.74 107.08 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 74.14 111.137 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -83.0 128.78 34.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.448 . . . . 71.4 110.896 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -113.7 103.04 10.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.442 . . . . 75.43 110.917 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -140.85 142.64 34.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 73.43 110.847 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.72 39.6 24.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 75.41 111.095 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 56.96 25.15 10.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 64.53 110.864 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.8 mtmm -132.0 152.75 50.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 75.54 110.874 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.1 mt -115.86 150.49 36.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.434 . . . . 75.12 110.92 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 7.9 t -168.4 145.35 3.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 72.54 110.852 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 35.4 mt -115.61 -32.09 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 75.41 111.089 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -89.37 1.61 55.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 70.21 110.8 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 60.31 18.18 7.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 72.55 110.852 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -132.22 -38.81 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 75.41 110.931 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.3 t -100.73 104.72 16.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 74.14 111.156 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -100.84 141.11 34.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 74.21 110.946 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -116.66 173.97 6.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 72.34 110.85 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.28 -17.56 22.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.094 -0.503 . . . . 74.24 110.941 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -170.49 158.71 6.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.08 -0.509 . . . . 71.2 110.877 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -39.42 63.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 72.34 110.925 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.9 ttt -51.29 -47.92 62.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 75.32 110.858 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -68.23 -41.59 81.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.918 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.93 -48.56 75.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.905 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.81 -40.23 86.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 74.21 111.165 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -56.67 -38.44 72.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.493 . . . . 74.52 110.864 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -51.13 25.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 73.21 110.821 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -64.28 -20.94 66.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 72.43 110.925 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 85.1 m -84.44 -29.48 26.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.118 -0.492 . . . . 71.02 111.122 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 89.0 m -79.44 -24.24 42.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.429 . . . . 74.11 111.167 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -162.54 166.15 25.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 70.41 110.907 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.89 -55.62 16.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 74.53 111.121 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 59.03 21.62 9.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.282 -0.417 . . . . 72.42 110.837 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 107.62 13.66 19.88 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.76 -0.733 . . . . 62.22 112.544 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.9 mp -108.15 136.25 48.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.882 0.372 . . . . 71.33 110.891 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 26.3 t -51.48 -30.25 19.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 70.05 110.942 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.9 t -151.65 119.39 6.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 64.02 111.195 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.76 153.24 2.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.256 -0.429 . . . . 75.51 110.953 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 6.3 mt -69.44 133.44 47.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.431 . . . . 75.4 110.996 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 22.4 mt -127.2 -51.23 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 72.22 111.158 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt -126.2 118.92 23.51 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.579 0.704 . . . . 75.11 110.892 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 131.91 22.31 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.712 2.275 . . . . 73.54 112.375 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 83.67 0.53 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 73.3 110.872 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 31.6 m -64.71 144.92 14.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.44 . . . . 75.23 111.162 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 72.41 110.872 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.729 0.3 . . . . 75.33 110.994 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 11.1 p -105.35 88.61 2.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 75.34 110.809 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -81.63 151.13 27.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.141 -0.481 . . . . 75.04 110.973 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.2 129.22 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 71.31 110.855 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.08 159.28 15.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 73.04 110.831 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 45.4 mtt180 -60.15 -18.48 47.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.094 -0.503 . . . . 74.12 110.873 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.05 -43.41 87.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 74.04 110.863 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.37 -23.18 17.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 70.12 110.918 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -144.52 77.45 13.82 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.624 0.726 . . . . 74.4 110.819 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.84 -5.8 17.12 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.703 2.268 . . . . 73.31 112.3 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.3 t -92.63 27.52 2.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.232 -0.44 . . . . 73.04 111.207 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 24.4 mt -103.92 136.71 43.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 73.25 110.88 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.1 t -104.5 171.99 7.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 75.35 111.149 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -49.35 -36.82 22.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.272 -0.422 . . . . 74.43 110.885 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.86 -52.08 66.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.197 -0.456 . . . . 73.23 110.932 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -64.15 -52.56 58.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.474 . . . . 73.01 110.932 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 48.0 mm -55.85 -54.52 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 74.51 111.208 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 33.3 t -59.43 -21.38 59.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 73.43 110.872 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.14 3.9 25.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 72.25 111.143 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.2 mtm . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 73.4 110.87 -179.995 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.457 -0.094 0 CA-C-O 120.935 0.397 . . . . 74.25 110.868 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.4 m 66.49 136.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 75.31 110.922 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 5.8 m -51.25 121.97 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 72.45 111.142 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -128.4 78.41 1.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 64.53 110.86 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 23.7 mtmt . . . . . 0 C--N 1.329 -0.318 0 CA-C-O 121.655 0.74 . . . . 75.32 110.844 179.936 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.174 0 CA-C-O 120.711 0.213 . . . . 72.21 112.272 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 38.9 p-90 -101.57 -30.51 11.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 74.45 110.909 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -86.41 99.09 11.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.41 . . . . 74.13 110.886 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -76.56 -40.39 49.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 73.54 110.903 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.83 24.86 54.98 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 75.23 112.506 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.96 66.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.743 0.306 . . . . 74.33 110.899 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 14.2 mm -129.74 144.32 38.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 74.02 111.131 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.49 170.49 9.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 72.41 111.105 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -60.9 -39.45 89.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 75.42 110.82 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -74.05 -33.78 63.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 73.33 110.9 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -70.82 -40.83 72.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 74.14 110.926 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.18 -34.13 61.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 73.33 111.135 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -60.07 -52.98 63.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 75.04 110.861 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.75 -36.35 82.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 75.43 110.929 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 11.1 mt -55.01 -38.26 67.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.131 -0.486 . . . . 72.5 110.92 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -102.03 43.76 1.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 71.4 110.929 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.49 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.54 -59.68 6.67 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.631 0.729 . . . . 74.22 110.897 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.81 123.61 10.25 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.64 2.227 . . . . 75.4 112.373 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 116.82 4.74 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.674 2.249 . . . . 71.03 112.351 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -154.87 115.16 3.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 72.35 110.939 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -66.6 111.69 3.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.166 -0.47 . . . . 73.52 111.165 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.19 -5.07 6.37 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.705 -0.759 . . . . 74.05 112.44 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.9 tp -90.6 113.15 25.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.838 0.352 . . . . 75.25 110.894 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 16.6 p90 -124.38 168.42 13.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 73.4 110.875 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -164.03 137.14 5.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 65.04 110.934 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 89.5 t -110.65 135.73 48.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 73.02 111.164 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -149.3 143.01 25.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 75.42 110.866 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -54.88 124.08 15.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.181 -0.463 . . . . 74.53 110.885 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.2 m -56.37 115.91 2.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.078 -0.51 . . . . 74.02 110.855 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.4 m -68.61 -56.28 8.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 72.55 111.13 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -68.19 -19.55 64.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 71.42 110.963 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.401 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 1.3 m-85 -124.75 93.15 46.61 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.673 0.749 . . . . 74.15 110.934 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 54.0 Cg_endo -69.71 119.84 6.72 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.668 2.245 . . . . 73.1 112.409 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.73 -10.45 23.42 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.792 -0.718 . . . . 62.43 112.473 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -119.46 -178.61 3.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.802 0.334 . . . . 71.11 110.838 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -130.59 162.15 29.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 70.43 110.885 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 96.4 m -130.32 125.33 34.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.111 -0.495 . . . . 75.33 111.195 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 30.2 tp -98.57 112.6 24.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.277 -0.419 . . . . 74.44 110.881 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.1 m -101.04 126.35 47.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 73.24 110.877 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.7 t -127.55 151.21 34.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 74.21 111.116 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.27 112.62 24.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 70.55 110.845 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.96 94.27 4.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 72.0 110.909 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 65.58 25.52 11.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.03 110.897 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.9 8.85 55.19 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 51.03 112.535 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -110.55 139.09 46.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.768 0.318 . . . . 74.52 110.874 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 69.3 t -95.17 101.21 12.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 75.14 111.162 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -90.24 110.23 21.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 73.55 110.88 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -89.03 124.52 34.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 74.32 110.84 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -113.93 104.49 12.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 72.22 110.908 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -53.76 133.66 42.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.08 -0.509 . . . . 74.02 110.845 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 65.2 mt -113.13 106.95 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.456 . . . . 63.44 111.153 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.1 ttm -76.69 129.31 36.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 72.53 110.942 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -114.88 115.97 27.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 74.03 110.972 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -149.58 137.03 20.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 74.13 110.869 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.46 36.11 24.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 62.52 111.101 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.57 25.41 14.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 73.01 110.813 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -126.24 144.02 50.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 72.31 110.892 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.9 mp -106.5 150.7 25.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.258 -0.428 . . . . 73.42 110.913 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -168.26 134.84 2.0 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.184 -0.462 . . . . 74.43 110.855 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 50.0 mt -110.77 -33.48 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 75.2 111.138 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . 0.42 ' O ' ' CG ' ' A' ' 142' ' ' GLU . 3.4 p30 -95.48 9.8 38.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.114 -0.494 . . . . 74.13 110.864 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 6.7 pt-20 45.48 31.29 0.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.54 110.973 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -131.86 -39.47 1.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.079 -0.51 . . . . 70.43 110.86 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.7 p -118.52 104.55 16.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 74.43 111.136 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -91.91 149.83 21.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 74.22 110.891 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -120.09 173.76 6.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 65.12 110.887 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -93.84 -18.19 22.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 72.44 110.886 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -172.05 158.7 4.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 64.11 110.888 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.19 -36.02 39.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 74.44 110.881 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.5 ttt -52.47 -51.14 60.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 74.4 110.928 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -65.99 -40.05 90.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 72.15 110.951 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.71 -49.71 72.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.212 -0.449 . . . . 73.21 110.927 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 96.5 t -59.04 -44.62 91.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 75.31 111.18 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -52.97 -38.99 62.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.102 -0.499 . . . . 70.55 110.837 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -53.43 16.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 70.22 110.882 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -62.65 -17.27 60.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 64.43 110.896 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 99.6 m -85.83 -32.46 21.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 72.25 111.15 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 16.2 m -79.68 -22.49 43.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 74.24 111.17 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -165.88 161.68 17.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 75.4 110.893 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.31 -58.35 6.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 72.52 111.108 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.01 16.6 9.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.256 -0.429 . . . . 52.51 110.873 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 115.3 1.45 21.95 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.695 -0.764 . . . . 71.22 112.467 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.41 140.39 29.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.801 0.334 . . . . 74.05 110.889 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 34.6 t -51.06 -30.56 16.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.201 -0.454 . . . . 73.12 110.848 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.6 t -158.66 125.11 4.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.246 -0.434 . . . . 75.14 111.183 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -50.77 146.22 6.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 74.44 110.857 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.3 mt -65.04 134.78 54.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 74.31 110.899 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 25.1 mt -127.13 -51.17 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 63.23 111.11 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.77 118.82 21.19 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.556 0.693 . . . . 75.41 110.904 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 141.96 46.81 Favored 'Trans proline' 0 C--O 1.232 0.215 0 C-N-CA 122.724 2.283 . . . . 73.41 112.375 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 82.51 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.237 -0.438 . . . . 74.32 110.923 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 13.5 m -65.0 124.76 20.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 75.1 111.124 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.2 ptm . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 74.22 110.887 179.911 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.731 0.3 . . . . 74.35 110.94 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.2 t -96.65 88.64 4.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.161 -0.472 . . . . 63.35 110.885 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -77.66 147.87 35.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.495 . . . . 74.41 110.904 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -151.39 129.54 11.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 72.44 110.929 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.84 175.0 5.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 74.31 110.843 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 36.4 mtt180 -64.24 -15.5 60.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.094 -0.503 . . . . 74.31 110.842 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.16 -42.75 99.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 75.03 110.836 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -102.43 -10.75 19.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.165 -0.47 . . . . 74.32 110.931 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -156.83 77.62 4.06 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.592 0.71 . . . . 72.42 110.862 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -6.26 18.18 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.712 2.275 . . . . 63.05 112.337 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.8 t -93.31 27.15 2.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 75.34 111.135 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 34.8 mt -103.98 136.84 42.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 74.11 110.947 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.7 t -103.4 174.24 5.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 74.52 111.13 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -49.87 -34.37 19.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 73.04 110.895 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.95 -48.95 72.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.482 . . . . 71.54 110.921 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -64.89 -52.22 57.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.074 -0.512 . . . . 75.43 110.872 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 43.9 mm -57.17 -53.28 45.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 72.22 111.145 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 46.8 m -63.67 -18.44 63.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 70.34 110.792 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.38 2.99 29.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 71.25 111.168 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.7 mtt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 62.42 110.925 179.952 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 13.2 p . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.914 0.388 . . . . 73.12 110.903 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 62.86 161.56 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.098 -0.501 . . . . 63.1 110.814 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 15.3 m -68.6 134.47 30.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.108 -0.497 . . . . 64.05 111.15 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -132.14 74.38 1.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 73.02 110.91 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 34.1 mttt . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.595 0.712 . . . . 72.05 110.876 179.878 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.783 0.243 . . . . 74.04 112.325 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 39.0 p-90 -102.86 -31.01 10.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.271 -0.422 . . . . 75.34 110.892 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -86.44 102.06 13.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.24 110.893 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -76.25 -36.63 58.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 62.15 110.891 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.39 18.75 37.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.736 -0.745 . . . . 73.41 112.554 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.51 78.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 74.34 110.872 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 13.4 mm -139.21 144.28 29.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 75.2 111.103 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.11 176.01 6.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.103 -0.499 . . . . 75.52 111.195 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.5 ppt_? -65.44 -39.12 91.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.224 -0.444 . . . . 75.22 110.908 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -74.61 -33.07 62.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.165 -0.47 . . . . 62.4 110.883 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -71.77 -43.06 66.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 75.01 110.878 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.04 -33.82 61.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 72.32 111.126 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -60.25 -53.28 59.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 72.23 110.892 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -36.58 83.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.489 . . . . 73.31 110.892 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 12.0 mt -55.01 -38.18 67.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.188 -0.46 . . . . 74.22 110.88 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -102.03 43.75 1.05 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.228 -0.442 . . . . 71.31 110.917 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.485 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.62 -59.91 6.27 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.679 0.752 . . . . 74.44 110.975 179.933 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.485 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.7 Cg_endo -69.83 123.25 9.89 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.631 2.22 . . . . 73.33 112.326 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 117.58 5.17 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.677 2.251 . . . . 74.31 112.331 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -154.81 108.17 2.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.176 -0.465 . . . . 70.53 110.905 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.79 112.79 2.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 74.33 111.19 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.09 -6.9 6.39 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.745 -0.741 . . . . 63.44 112.495 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.13 115.44 27.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.855 0.36 . . . . 72.34 110.924 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -126.77 164.36 21.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 74.32 110.882 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -161.13 137.93 8.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 72.3 110.879 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.3 t -110.3 140.27 30.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 74.42 111.08 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -153.15 145.58 24.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 73.11 110.866 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.53 125.02 13.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 72.14 110.895 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.5 m -58.38 113.19 1.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 75.53 110.774 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.9 m -68.92 -56.27 8.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 63.24 111.097 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -65.02 -27.88 69.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 75.21 110.917 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -117.64 94.62 46.2 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.675 0.75 . . . . 75.24 110.927 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 118.09 5.48 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.656 2.237 . . . . 64.21 112.338 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.57 -1.32 24.85 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.757 -0.735 . . . . 62.44 112.485 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -129.06 -173.41 2.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.799 0.333 . . . . 73.12 110.872 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -134.52 166.61 22.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.88 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 57.6 m -138.38 141.6 39.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.098 -0.501 . . . . 72.25 111.14 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.96 118.23 35.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 75.32 110.949 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.5 m -101.59 125.92 48.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.44 . . . . 72.53 110.892 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.4 t -126.1 150.91 31.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 73.31 111.12 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.99 111.64 24.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.44 110.878 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.73 93.11 3.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.475 . . . . 75.24 110.931 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 66.81 29.8 8.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 74.34 110.936 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.9 -14.0 63.17 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.763 -0.732 . . . . 74.43 112.508 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -88.14 139.29 30.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 72.42 110.919 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 95.6 t -100.09 111.27 29.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.138 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -100.96 124.18 46.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 71.23 110.928 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -101.6 124.76 47.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 74.41 110.825 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -112.3 112.73 24.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.467 . . . . 71.53 110.968 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -62.2 139.27 58.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 73.54 110.883 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.2 mt -119.69 109.61 26.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 74.52 111.104 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.38 123.29 30.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 73.12 110.89 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -112.4 98.23 7.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 73.4 110.951 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -131.47 142.61 50.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 74.5 110.865 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.65 36.1 26.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 75.24 111.113 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.51 26.44 16.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 60.42 110.872 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -131.34 139.33 49.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 72.34 110.907 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.0 mp -102.08 150.46 23.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.465 . . . . 74.31 110.93 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -167.79 138.37 2.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 74.43 110.875 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 50.3 mt -112.93 -34.87 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 75.04 111.071 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -89.14 -1.67 58.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.254 -0.43 . . . . 74.33 110.853 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 61.12 17.49 8.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 74.4 110.805 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -127.21 -33.36 2.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.22 110.915 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -113.36 104.86 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 71.43 111.103 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -97.19 145.65 25.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 73.51 111.009 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -118.52 178.1 4.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 74.41 110.806 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.68 -15.63 17.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.112 -0.495 . . . . 74.34 110.912 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -165.48 172.2 12.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 74.24 110.871 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.71 -23.88 58.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 75.11 110.901 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -57.19 11.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 74.52 110.866 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -65.08 -35.33 80.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 73.31 110.908 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.57 -47.57 76.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.43 110.929 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 75.2 t -64.99 -39.48 85.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 72.21 111.142 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -54.43 -37.83 65.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.109 -0.496 . . . . 74.32 110.958 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.03 -44.84 62.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.107 -0.497 . . . . 72.4 110.88 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -67.96 -22.09 65.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.451 . . . . 75.2 110.898 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.5 m -84.24 -30.04 26.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 72.33 111.164 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 19.2 m -78.96 -25.83 43.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.213 -0.449 . . . . 74.44 111.118 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.66 161.68 29.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.194 -0.457 . . . . 52.2 110.868 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.1 -58.32 6.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.419 . . . . 64.43 111.103 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 60.2 19.51 8.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.459 . . . . 73.44 110.907 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 114.43 0.76 23.44 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.696 -0.764 . . . . 73.54 112.449 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -93.83 139.2 31.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.888 0.375 . . . . 75.41 110.918 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 36.0 t -51.27 -30.29 17.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 74.12 110.822 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.1 t -156.42 125.7 6.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 72.41 111.137 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -50.73 142.22 11.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.227 -0.442 . . . . 74.34 110.819 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 8.6 mt -64.31 134.62 55.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.14 -0.482 . . . . 75.44 110.847 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 28.8 mt -121.77 -51.25 3.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 72.4 111.112 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -132.42 126.36 20.19 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.595 0.712 . . . . 75.1 110.887 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.85 140.58 42.69 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.662 2.241 . . . . 64.44 112.343 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.09 83.48 0.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.274 -0.421 . . . . 75.35 110.931 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 29.1 m -64.46 129.91 28.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 75.42 111.173 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.4 ptt? . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 74.22 110.899 179.949 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.793 0.33 . . . . 74.33 110.926 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.91 88.5 2.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 70.53 110.801 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -74.63 149.23 40.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.153 -0.476 . . . . 75.23 110.92 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -144.55 129.09 18.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.106 -0.497 . . . . 75.13 110.904 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.79 157.02 17.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 73.41 110.852 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -59.31 -18.94 42.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.093 -0.503 . . . . 75.42 110.869 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -36.65 84.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 72.4 110.85 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -97.7 -24.55 15.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 72.45 110.893 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -144.59 79.21 12.59 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.677 0.751 . . . . 72.54 110.915 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 -5.83 17.19 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.617 2.211 . . . . 71.5 112.326 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.0 t -93.24 27.43 2.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 75.53 111.145 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 29.2 mt -101.31 136.83 40.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.235 -0.439 . . . . 75.15 110.981 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.2 t -105.95 172.81 6.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 75.14 111.118 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -49.43 -37.34 25.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 65.43 110.924 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -60.75 -52.43 65.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 74.14 110.85 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -63.64 -52.39 60.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.475 . . . . 70.12 110.915 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 43.3 mm -55.83 -53.77 34.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 73.3 111.171 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 7.8 t -58.67 -22.84 58.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 73.52 110.855 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.54 4.28 25.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 64.42 111.054 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.4 mtm . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 72.54 110.894 179.979 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 21.2 p . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.897 0.38 . . . . 70.05 110.829 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 66.65 130.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 73.44 110.853 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 6.0 m -50.22 133.51 10.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 72.1 111.112 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.49 74.48 1.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 71.14 110.892 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.8 mttp . . . . . 0 C--N 1.329 -0.316 0 CA-C-O 121.627 0.727 . . . . 74.54 110.911 179.872 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.23 0.119 0 CA-C-O 120.735 0.223 . . . . 71.55 112.283 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 32.4 p-90 -101.51 -30.73 11.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.439 . . . . 75.11 110.888 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -89.91 108.1 19.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.419 . . . . 74.2 110.936 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 17.7 m-70 -83.44 -46.97 11.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 72.32 110.891 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.89 33.0 71.57 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.707 -0.759 . . . . 63.22 112.538 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.61 33.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.712 0.292 . . . . 74.15 110.922 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.4 mm -103.3 144.07 14.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.42 111.072 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.19 159.35 16.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.125 -0.488 . . . . 75.43 111.213 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -54.14 -37.94 64.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 74.43 110.904 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -77.15 -32.05 56.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.232 -0.44 . . . . 73.44 110.829 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -70.09 -39.49 75.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 72.03 110.915 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.99 -35.99 62.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 73.32 111.151 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -58.87 -52.85 63.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 54.52 110.927 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.75 -35.63 80.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.495 . . . . 74.11 110.862 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 11.5 mt -54.9 -38.49 67.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 74.54 110.926 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -98.46 43.67 1.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 74.03 110.949 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.49 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.72 -59.92 6.15 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.622 0.725 . . . . 75.34 110.912 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.9 Cg_endo -69.68 123.35 10.04 Favored 'Trans proline' 0 N--CA 1.465 -0.195 0 C-N-CA 122.73 2.287 . . . . 74.43 112.347 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 117.67 5.22 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.68 2.254 . . . . 75.31 112.333 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.9 105.29 2.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.217 -0.447 . . . . 75.52 110.862 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.64 111.9 1.42 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.127 -0.488 . . . . 64.11 111.11 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.32 -5.09 6.32 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.718 -0.753 . . . . 64.11 112.511 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.31 117.49 29.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.876 0.37 . . . . 74.23 110.924 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -128.5 166.79 18.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.164 -0.471 . . . . 72.31 110.885 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -164.23 138.72 5.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 74.41 110.874 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.9 t -109.92 131.19 61.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 73.54 111.211 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.26 145.71 41.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 71.2 110.879 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.76 123.92 8.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 74.14 110.893 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.5 m -62.16 109.3 1.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 62.23 110.856 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.5 m -68.69 -56.31 8.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 73.33 111.167 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . 0.456 ' ND2' ' HH ' ' B' ' 296' ' ' TYR . 67.2 m-80 -64.38 -27.04 68.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.196 -0.457 . . . . 72.4 110.823 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -118.43 95.73 49.03 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.677 0.751 . . . . 72.21 110.869 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 114.34 3.67 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.638 2.225 . . . . 64.33 112.368 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.41 -1.18 25.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.729 -0.748 . . . . 72.0 112.532 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -123.47 -172.97 2.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.789 0.328 . . . . 74.35 110.832 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -139.98 145.12 37.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.904 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.4 m -113.6 141.63 46.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 72.22 111.136 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.14 118.97 36.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.244 -0.434 . . . . 74.54 110.913 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 14.7 t -102.66 129.94 49.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.445 . . . . 73.24 110.85 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.7 t -128.53 150.01 33.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.03 111.092 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.12 112.45 25.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 74.41 110.895 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.13 91.46 3.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.116 -0.493 . . . . 70.24 110.862 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 66.35 32.21 7.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 73.0 110.896 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.34 -13.76 64.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.712 -0.756 . . . . 54.14 112.476 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.03 145.69 25.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.833 0.349 . . . . 75.33 110.909 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 6.8 m -106.08 116.38 49.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 74.11 111.166 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -107.28 122.8 47.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 74.53 110.822 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -99.78 124.16 44.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 62.32 110.804 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -110.8 116.99 32.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 54.14 110.881 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 129.73 40.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 75.55 110.78 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 33.3 mt -113.66 109.41 28.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 73.2 111.153 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -81.41 125.22 30.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 71.04 110.913 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -114.97 101.06 8.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.261 -0.427 . . . . 73.53 110.907 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -137.36 142.55 41.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 74.11 110.894 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.66 35.87 24.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 73.54 111.158 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 2.7 t 60.26 31.87 20.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 75.04 110.795 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mtmm -137.92 142.56 40.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.174 -0.466 . . . . 74.32 110.884 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mp -105.64 152.2 23.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 70.41 110.929 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -169.59 139.94 2.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.449 . . . . 73.45 110.816 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 58.4 mt -115.65 -37.14 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 74.33 111.145 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -89.19 -5.26 57.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 75.13 110.915 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 61.98 15.87 7.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 63.23 110.901 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -123.79 -9.19 7.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.074 -0.512 . . . . 74.24 110.896 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.5 t -143.48 104.53 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.101 -0.5 . . . . 62.52 111.073 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -94.99 145.47 24.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 54.33 110.89 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -117.09 178.05 4.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 73.45 110.869 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.68 -15.69 17.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 64.54 110.92 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -165.76 172.07 12.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 71.33 110.849 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.5 -23.26 58.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 74.44 110.894 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.5 ttp -62.55 -57.19 12.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 65.44 110.864 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -65.73 -35.66 81.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.456 . . . . 74.14 110.97 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.54 -48.46 74.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.466 . . . . 72.54 110.958 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 71.0 t -64.79 -38.01 81.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.489 . . . . 75.12 111.124 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -55.4 -38.32 68.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 74.12 110.904 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -72.22 -45.2 61.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.43 110.826 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -69.92 -15.82 63.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 75.1 110.968 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 96.8 m -86.96 -34.16 19.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.079 -0.509 . . . . 74.32 111.128 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.5 t -80.09 -23.45 41.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 60.04 111.164 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.25 153.65 24.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 64.35 110.855 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.51 -58.16 7.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 45.42 111.116 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 56.21 25.19 8.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 55.2 110.928 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 119.28 -11.3 11.5 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.742 -0.742 . . . . 71.42 112.483 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -86.93 138.38 31.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.896 0.379 . . . . 73.54 110.894 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 19.5 t -51.23 -29.51 14.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.141 -0.481 . . . . 73.01 110.856 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 4.5 t -158.99 128.13 5.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 72.4 111.095 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -51.62 139.53 20.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 75.45 110.928 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 8.5 mt -60.95 139.54 58.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.258 -0.428 . . . . 75.34 110.874 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 26.4 mt -127.13 -51.5 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 65.52 111.148 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -128.15 122.04 21.94 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.578 0.704 . . . . 74.32 110.932 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 138.45 37.99 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.753 2.302 . . . . 72.52 112.329 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.42 84.03 0.4 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 61.42 110.899 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 28.7 m -64.38 138.52 22.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.438 . . . . 71.52 111.174 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.1 ptm . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 75.45 110.844 179.992 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.774 0.321 . . . . 73.34 110.899 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 4.4 p -96.72 88.88 4.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 61.53 110.859 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . 0.456 ' HH ' ' ND2' ' A' ' 111' ' ' ASN . 36.5 t80 -77.0 145.64 37.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.11 -0.495 . . . . 73.55 110.962 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -136.7 129.58 30.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 63.34 110.888 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -91.82 164.31 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.276 -0.42 . . . . 64.43 110.853 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 28.6 mtt180 -67.78 -12.47 60.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 71.15 110.889 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.23 -37.84 66.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 74.21 110.889 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -95.93 -16.84 21.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.139 -0.482 . . . . 73.23 110.904 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -153.73 79.08 5.39 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.646 0.736 . . . . 70.2 110.912 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 -6.57 18.88 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.709 2.272 . . . . 70.51 112.33 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 15.3 t -93.78 27.24 2.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 73.21 111.113 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 44.5 mt -101.31 136.79 40.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.202 -0.454 . . . . 71.54 110.985 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 10.0 t -103.17 169.99 8.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 73.45 111.103 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -49.66 -32.5 13.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.21 110.856 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -63.98 -47.64 79.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 71.24 110.875 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -65.34 -49.27 70.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 63.05 110.879 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 24.3 mm -61.54 -53.24 51.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 73.32 111.202 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 79.3 p -58.57 -23.39 58.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 73.04 110.855 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -78.79 -1.63 35.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.479 . . . . 73.44 111.062 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 74.43 110.931 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.816 0.341 . . . . 63.12 110.808 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 5.8 t 65.12 151.69 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 73.05 110.838 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.02 120.32 4.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.093 -0.503 . . . . 73.42 111.14 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -127.34 74.85 1.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 72.42 110.918 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 121.654 0.74 . . . . 74.23 110.881 179.925 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo . . . . . 0 N--CA 1.465 -0.163 0 CA-C-O 120.872 0.28 . . . . 71.41 112.379 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 37.0 p-90 -100.2 -25.99 14.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.465 . . . . 72.41 110.918 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -98.73 103.14 15.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.249 -0.432 . . . . 75.24 110.913 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -79.58 -45.43 19.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 72.2 110.938 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 60.82 35.31 89.88 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.699 -0.762 . . . . 72.11 112.497 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.3 34.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.743 0.306 . . . . 73.51 110.885 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 16.7 mm -109.19 144.96 16.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 74.21 111.133 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -97.76 177.5 5.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 72.22 111.141 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ppt_? -65.35 -40.7 93.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 65.24 110.872 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -38.06 89.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 74.22 110.889 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.11 -37.7 57.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 72.44 110.93 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.61 -36.26 78.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 71.42 111.089 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -67.83 -53.06 29.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.158 -0.474 . . . . 74.32 110.913 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.09 -35.0 79.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 72.42 110.82 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.17 -36.02 82.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 74.42 110.94 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -103.19 43.44 1.08 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.18 -0.464 . . . . 71.41 110.951 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.482 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.27 -60.12 4.41 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.776 0.798 . . . . 73.42 110.914 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.482 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.74 123.32 9.99 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.627 2.218 . . . . 72.54 112.388 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.78 118.14 5.5 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.72 2.28 . . . . 75.24 112.297 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -155.01 111.08 3.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 73.01 110.884 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.16 112.69 2.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.068 -0.515 . . . . 70.34 111.154 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.97 -6.94 6.43 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.809 -0.71 . . . . 70.3 112.556 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.26 114.6 26.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.842 0.353 . . . . 75.03 110.835 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 20.2 p90 -126.24 164.34 21.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 74.33 110.927 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -161.24 136.45 7.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 75.13 110.928 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 86.2 t -110.19 132.84 57.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 73.42 111.161 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -142.3 149.96 40.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 73.33 110.846 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.22 124.05 15.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 75.12 110.911 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.8 m -60.02 112.6 1.94 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 71.13 110.857 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.9 m -68.68 -53.29 23.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 75.41 111.161 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -63.86 -29.45 70.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 75.12 110.9 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -123.45 97.4 42.45 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.648 0.737 . . . . 72.43 110.983 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.68 123.85 10.54 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.654 2.236 . . . . 73.22 112.398 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.61 -14.99 22.26 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.763 -0.732 . . . . 74.43 112.453 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -116.15 -175.34 2.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.777 0.322 . . . . 71.12 110.809 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -135.92 156.63 48.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 71.15 110.95 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 92.3 m -128.05 131.06 49.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 64.03 111.173 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.01 124.36 43.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.288 -0.415 . . . . 72.41 110.988 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.9 t -108.44 125.79 52.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 73.12 110.89 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.1 t -124.86 151.57 30.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 75.24 111.195 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -101.9 111.24 23.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 74.32 110.818 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.28 89.73 3.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 55.52 110.93 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 67.97 31.71 5.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 71.33 110.799 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.94 -14.48 62.71 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.738 -0.744 . . . . 74.32 112.515 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -88.09 139.79 30.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.839 0.352 . . . . 73.41 110.941 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 7.3 m -100.44 106.74 19.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 75.24 111.085 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -95.77 121.31 37.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 73.03 110.949 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -100.75 124.88 47.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 73.51 110.848 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -112.66 120.24 40.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.169 -0.469 . . . . 73.43 110.882 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -67.86 133.11 48.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.1 -0.5 . . . . 75.43 110.91 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 49.7 mt -117.34 107.63 22.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 73.32 111.129 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.6 ttm -83.01 123.34 29.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 74.25 110.888 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -114.07 100.8 8.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.312 -0.404 . . . . 73.11 110.949 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -136.36 142.5 43.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 75.4 110.801 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.17 35.99 25.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 75.52 111.114 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.4 t 60.33 29.76 19.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.239 -0.437 . . . . 72.1 110.811 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -136.31 140.99 43.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 74.14 110.873 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.0 mp -101.93 153.72 19.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 72.43 110.915 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.59 139.21 2.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.48 . . . . 71.21 110.863 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 50.1 mt -115.5 -28.9 2.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 71.01 111.108 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -101.14 -5.32 25.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.161 -0.472 . . . . 71.03 110.873 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 63.63 14.62 8.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.835 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -119.42 -19.74 8.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.446 . . . . 74.03 110.918 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -133.7 104.3 6.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.108 -0.497 . . . . 73.44 111.128 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -94.04 144.87 25.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.218 -0.447 . . . . 75.24 110.9 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -113.04 175.08 5.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.124 -0.489 . . . . 73.34 110.874 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -96.02 -16.91 21.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.141 -0.481 . . . . 75.35 110.861 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -173.77 158.82 3.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 62.22 110.893 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.5 -36.31 44.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 74.33 110.935 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.9 ttp -52.29 -51.39 58.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 73.5 110.902 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -66.0 -39.63 90.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 75.45 110.944 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.67 -53.41 56.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 74.32 110.907 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 69.4 t -61.5 -36.7 74.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 74.11 111.118 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -54.99 -40.27 69.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 74.03 110.903 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.21 -52.3 17.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 75.12 110.891 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -62.72 -17.15 60.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 74.34 110.94 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.3 m -87.44 -32.79 19.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.085 -0.507 . . . . 73.1 111.126 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 19.3 m -77.46 -21.56 52.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.254 -0.43 . . . . 75.13 111.182 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.74 176.35 4.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 74.32 110.832 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.88 -58.13 6.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 73.35 111.111 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.81 19.68 8.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 72.15 110.855 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 116.66 -8.45 17.14 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.742 -0.742 . . . . 72.25 112.423 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.1 mp -94.5 148.06 22.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.863 0.363 . . . . 75.23 110.869 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 22.1 p -54.35 -27.25 34.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 75.32 110.983 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 14.7 t -159.55 133.74 7.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.126 -0.488 . . . . 74.3 111.101 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.3 ptt-85 -53.93 173.14 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 72.33 110.91 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 15.0 mt -93.82 141.73 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 71.51 110.895 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 30.4 mt -125.41 -51.19 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.194 -0.457 . . . . 65.45 111.213 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -128.81 122.4 21.47 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.563 0.697 . . . . 73.31 110.886 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 138.41 37.56 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.635 2.223 . . . . 73.23 112.352 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.81 84.55 0.31 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 72.24 110.899 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.1 m -64.32 135.28 28.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 74.23 111.1 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.5 mtm . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 73.24 110.847 179.87 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.79 0.328 . . . . 74.11 110.896 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -91.64 88.56 6.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 53.1 110.883 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -77.91 126.78 31.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 74.33 110.912 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -123.77 128.26 49.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.094 -0.503 . . . . 74.44 110.879 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 5.8 m -88.99 165.24 14.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 74.44 110.92 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -59.53 -19.16 46.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 74.32 110.886 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -37.01 82.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 74.13 110.887 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -104.28 -21.1 13.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 64.51 110.854 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -141.57 77.22 19.63 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.618 0.723 . . . . 74.14 110.813 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -6.76 19.37 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.732 2.288 . . . . 75.32 112.328 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 10.4 t -93.79 27.45 2.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.192 -0.458 . . . . 74.33 111.152 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 48.3 mt -100.84 136.96 39.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.192 -0.458 . . . . 75.32 110.89 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.6 t -108.84 174.35 5.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 75.13 111.183 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -50.26 -35.37 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.254 -0.43 . . . . 72.23 110.847 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -63.16 -46.88 85.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.131 -0.486 . . . . 75.13 110.935 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -68.4 -47.58 66.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.137 -0.483 . . . . 72.33 110.889 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 44.2 mm -56.03 -45.41 80.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 75.22 111.124 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 59.0 p -76.67 -15.86 59.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 70.15 110.859 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -74.92 -17.27 60.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.499 . . . . 72.35 111.066 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.5 ptp . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 44.45 110.875 179.971 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 13.7 t . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.851 0.358 . . . . 71.13 110.808 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.1 p 67.28 131.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 73.35 110.894 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 2.1 p -48.59 130.88 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.131 -0.486 . . . . 75.31 111.112 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -146.72 74.65 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 74.54 110.868 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.7 mttt . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 121.582 0.706 . . . . 74.24 110.847 179.934 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.158 0 CA-C-O 120.75 0.229 . . . . 73.1 112.319 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 41.5 p-90 -102.18 -26.15 13.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.23 -0.441 . . . . 74.43 110.893 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -96.01 99.7 11.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 75.13 110.857 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.8 m-70 -75.63 -36.68 60.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 65.04 110.926 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.71 27.36 58.83 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.703 -0.761 . . . . 63.42 112.52 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.46 63.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.83 0.348 . . . . 75.12 110.973 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 15.3 mm -126.76 144.0 38.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.468 . . . . 75.41 111.13 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.93 171.83 8.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.21 111.173 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.6 ppt_? -63.32 -38.24 90.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 74.42 110.839 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -76.63 -30.84 57.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 73.44 110.991 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -70.9 -43.28 68.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.099 -0.501 . . . . 74.03 110.957 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.72 -37.26 67.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 74.44 111.152 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.79 -53.1 62.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 71.42 110.906 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -33.91 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 75.25 110.841 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 9.8 mt -54.69 -38.23 66.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 74.54 110.925 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -100.33 43.5 1.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.22 -0.446 . . . . 73.21 110.92 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.489 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -64.32 -59.94 9.75 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.678 0.751 . . . . 74.45 110.941 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.4 Cg_endo -69.68 123.15 9.84 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.64 2.227 . . . . 73.24 112.394 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.67 116.56 4.61 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 122.667 2.245 . . . . 75.34 112.37 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -154.99 108.76 2.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.43 . . . . 61.21 110.901 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.61 111.93 2.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 74.22 111.15 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.66 -6.82 6.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.731 -0.747 . . . . 64.42 112.511 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 tp -89.73 111.95 23.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.836 0.351 . . . . 71.44 110.899 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.7 p90 -124.05 167.94 13.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 74.45 110.878 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -164.67 135.22 4.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.915 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.6 t -110.25 138.35 38.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.472 . . . . 72.11 111.074 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -150.66 154.32 37.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.096 -0.502 . . . . 74.32 110.851 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -51.85 124.39 12.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 74.15 110.92 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.9 m -63.84 113.39 3.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.226 -0.443 . . . . 73.13 110.861 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 m -68.9 -56.35 8.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.109 -0.496 . . . . 72.11 111.173 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -68.67 -23.86 64.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 71.01 110.942 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -115.42 94.77 40.88 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.693 0.759 . . . . 74.15 111.004 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 109.94 2.43 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.659 2.24 . . . . 73.13 112.372 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.43 3.49 24.04 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.723 -0.751 . . . . 72.24 112.536 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -129.4 -175.84 3.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.819 0.342 . . . . 71.0 110.92 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -135.93 144.87 45.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 74.21 110.948 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.7 m -108.58 141.59 40.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 75.21 111.144 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.79 107.98 16.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 75.22 110.891 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 10.5 t -93.07 134.9 34.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 64.02 110.878 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.0 t -138.07 148.35 25.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 72.33 111.126 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.51 111.64 23.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 62.41 110.905 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -113.86 91.49 3.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.142 -0.481 . . . . 71.12 110.856 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 66.38 31.55 8.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 74.24 110.913 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.98 -13.28 63.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.741 -0.742 . . . . 52.43 112.544 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -87.96 140.0 29.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.799 0.333 . . . . 74.34 110.887 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.7 t -98.77 108.15 21.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 75.42 111.13 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -101.67 128.52 47.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 74.44 110.909 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 -105.41 125.04 50.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 75.34 110.874 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -112.71 116.72 30.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.469 . . . . 63.32 110.909 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.22 137.19 44.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.125 -0.489 . . . . 74.4 110.811 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 39.8 mt -118.17 109.59 27.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 74.23 111.093 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.85 124.19 28.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 71.5 110.94 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -113.39 98.19 6.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.24 -0.436 . . . . 75.0 110.917 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -131.51 142.6 49.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.051 -0.522 . . . . 73.44 110.862 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.98 35.97 26.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.222 -0.445 . . . . 75.15 111.107 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 61.08 30.24 19.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 63.03 110.906 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -134.82 141.09 46.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.094 -0.503 . . . . 75.32 110.917 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.9 mp -102.39 149.52 24.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.442 . . . . 75.02 110.892 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 14.0 t -166.9 137.8 3.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 73.01 110.861 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 53.2 mt -115.7 -32.16 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.51 . . . . 74.34 111.16 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . 0.422 ' O ' ' CG ' ' A' ' 142' ' ' GLU . 49.3 t0 -97.39 10.6 39.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 71.23 110.89 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 9.7 pt-20 45.96 29.89 0.82 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.157 -0.474 . . . . 71.41 110.888 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -132.51 -40.08 1.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 73.42 110.867 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.7 p -116.28 104.62 16.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 73.24 111.11 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -93.41 150.75 20.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 72.31 110.952 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -121.08 178.2 4.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.193 -0.458 . . . . 75.24 110.896 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -100.37 -16.08 17.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 75.25 110.891 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -164.88 172.5 12.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 72.21 110.853 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.6 -27.55 60.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 72.34 110.893 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.7 -57.21 14.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 71.14 110.85 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -66.04 -36.36 83.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 73.11 110.951 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.63 -49.52 72.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.926 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 71.3 t -63.42 -38.36 81.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 75.41 111.121 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.99 -39.35 68.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 73.14 110.844 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -71.42 -44.55 64.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 74.24 110.817 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -68.26 -20.81 64.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 64.24 110.925 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 67.2 m -84.66 -30.39 24.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 72.15 111.161 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 13.2 m -79.68 -25.12 41.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.268 -0.424 . . . . 75.44 111.123 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -162.27 155.48 20.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 74.51 110.898 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.35 -58.4 6.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 73.4 111.089 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 51.77 29.81 6.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 73.54 110.876 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 120.57 -14.7 9.92 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.735 -0.745 . . . . 62.14 112.462 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -88.13 136.9 32.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.915 0.388 . . . . 74.34 110.939 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 19.3 p -53.86 -26.46 24.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 53.31 110.851 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 10.2 t -157.58 127.55 6.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 72.04 111.151 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -54.98 140.44 37.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 75.35 110.841 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 8.1 mt -60.31 141.44 56.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.464 . . . . 71.44 110.901 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 24.2 mt -126.97 -51.41 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 64.43 111.081 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -131.68 124.27 19.8 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.538 0.685 . . . . 75.0 110.922 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.89 136.65 33.17 Favored 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.664 2.243 . . . . 73.52 112.296 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.73 85.0 0.31 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 72.31 110.89 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 25.2 m -64.12 133.17 29.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 73.32 111.118 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 28.4 mtp . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 75.54 110.911 179.921 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.828 0.347 . . . . 73.44 110.934 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.83 88.82 6.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 74.14 110.86 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -77.82 147.52 35.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 72.13 111.006 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.19 129.23 19.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 72.24 110.859 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.27 160.12 14.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 74.14 110.817 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 -61.82 -17.26 55.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 75.02 110.953 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -37.13 84.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 73.42 110.909 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -97.99 -19.17 18.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 65.11 110.915 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -150.98 80.08 6.74 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.608 0.718 . . . . 75.3 110.872 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 -6.58 18.94 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.652 2.234 . . . . 72.25 112.348 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.7 t -94.06 27.45 2.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 73.33 111.049 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 46.2 mt -100.81 136.84 40.03 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.267 -0.424 . . . . 75.11 110.959 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 10.8 t -105.56 171.0 7.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 73.24 111.093 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -49.57 -35.42 20.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 72.34 110.848 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -61.38 -47.78 84.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.152 -0.476 . . . . 72.42 110.903 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -67.97 -52.08 39.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 74.32 110.84 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 40.2 mm -56.65 -53.52 40.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 72.21 111.183 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 84.1 p -57.28 -29.85 64.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 65.33 110.789 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -69.91 -10.25 57.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 72.45 111.101 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 64.43 110.854 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 24.3 p . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.883 0.373 . . . . 75.44 110.873 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.11 151.61 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 71.43 110.884 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 5.7 m -55.89 122.89 5.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.17 -0.468 . . . . 75.51 111.143 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -131.34 74.63 1.6 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 60.11 110.846 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 121.546 0.688 . . . . 75.14 110.886 179.866 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 N--CA 1.466 -0.147 0 CA-C-O 120.795 0.248 . . . . 73.22 112.382 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 50.1 p-90 -54.76 -26.67 35.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 75.13 110.893 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -88.0 100.65 13.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.295 -0.411 . . . . 74.13 110.888 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -75.68 -38.39 58.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.488 . . . . 73.14 110.883 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.68 18.84 40.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.799 -0.715 . . . . 73.12 112.473 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.72 81.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.775 0.322 . . . . 75.42 110.884 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 29.3 mm -147.1 145.16 19.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.245 -0.434 . . . . 74.42 111.145 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -97.82 177.29 5.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 73.03 111.132 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -38.86 89.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 73.22 110.905 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -37.68 88.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.246 -0.434 . . . . 72.54 110.973 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -37.06 57.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.077 -0.511 . . . . 74.35 110.966 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.37 -33.79 65.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 71.13 111.132 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -67.74 -53.09 30.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 74.14 110.923 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.16 -39.26 94.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 74.22 110.853 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.1 mt -58.97 -37.57 77.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 75.11 110.942 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -100.88 43.07 1.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.442 . . . . 75.42 110.902 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.483 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -70.01 -59.92 3.98 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.668 0.747 . . . . 74.23 110.924 -179.978 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.0 Cg_endo -69.74 124.05 10.71 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.771 2.314 . . . . 75.22 112.309 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 117.32 5.01 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.648 2.232 . . . . 74.42 112.407 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -155.09 102.6 2.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 74.42 110.884 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.03 111.51 0.96 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 72.0 111.142 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 131.28 -10.5 5.59 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.755 -0.736 . . . . 60.52 112.47 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -86.71 111.64 20.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.823 0.344 . . . . 73.31 110.933 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -124.2 162.38 23.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 70.45 110.888 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -159.11 135.76 9.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 75.1 110.931 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 93.1 t -109.9 134.71 51.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.221 -0.445 . . . . 75.25 111.078 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 7.5 ptt85 -148.27 141.67 25.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.451 . . . . 74.54 110.941 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -51.29 128.65 22.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 64.25 110.906 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.23 116.87 3.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 74.31 110.861 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.8 m -70.23 -26.28 63.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 75.15 111.121 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -106.68 -0.91 23.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.2 -0.455 . . . . 71.4 110.946 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -139.95 90.41 10.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.641 0.734 . . . . 70.31 110.969 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 118.34 5.62 Favored 'Trans proline' 0 C--N 1.34 0.131 0 C-N-CA 122.648 2.232 . . . . 74.2 112.345 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 114.19 -14.68 21.03 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.777 -0.725 . . . . 65.21 112.533 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -120.14 158.84 26.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.783 0.325 . . . . 74.31 110.911 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -113.86 149.32 35.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 72.34 110.886 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.5 m -125.48 124.51 41.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 65.41 111.125 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.38 134.39 39.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 75.1 110.957 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 48.8 t -116.94 127.06 53.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.455 . . . . 75.02 110.934 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.7 t -123.68 152.82 29.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.46 . . . . 74.14 111.097 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -104.39 112.13 25.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 54.52 110.883 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.76 95.7 5.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 73.43 110.915 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 67.68 28.55 7.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.465 . . . . 75.44 110.938 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.74 -14.39 63.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.746 -0.74 . . . . 65.24 112.51 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 142.45 27.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.37 . . . . 72.35 110.897 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 12.1 m -100.57 114.28 38.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.476 . . . . 72.54 111.185 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -104.69 123.79 48.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 72.02 110.855 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -100.52 129.17 46.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.484 . . . . 73.13 110.873 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -117.94 104.01 10.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.186 -0.461 . . . . 64.32 110.901 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.02 140.18 52.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 74.14 110.905 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 44.2 mt -124.97 109.39 22.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 71.44 111.083 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.65 131.7 36.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 73.33 110.832 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -117.62 102.4 9.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.24 -0.436 . . . . 73.54 110.898 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -138.76 142.59 38.8 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 75.31 110.833 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 59.06 35.96 24.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 73.24 111.117 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 59.88 31.14 20.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.431 . . . . 64.33 110.835 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -137.8 143.16 40.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.468 . . . . 74.43 110.954 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mp -105.57 152.18 23.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 72.13 110.946 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 43.9 t -169.91 141.65 2.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 61.32 110.837 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 44.5 mt -113.31 -36.39 2.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 74.33 111.175 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 9.0 p30 -87.9 -1.57 58.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 62.21 110.886 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 61.07 17.38 7.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 74.04 110.812 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -126.19 -32.29 2.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 74.11 110.902 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -114.03 104.85 17.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.491 . . . . 74.14 111.068 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -97.63 144.35 27.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 64.52 110.886 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -117.72 171.58 7.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 73.44 110.892 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.23 -15.45 31.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 72.1 110.914 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -175.27 158.65 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 75.3 110.919 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.43 -36.73 45.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.467 . . . . 74.44 110.897 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.1 ttt -51.84 -50.17 61.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 72.32 110.956 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -67.89 -41.6 82.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 73.42 110.925 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -47.38 77.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 71.15 110.918 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 89.7 t -63.77 -38.03 81.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 74.33 111.074 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -57.86 -38.33 75.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.137 -0.483 . . . . 74.31 110.852 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.81 -48.16 48.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 64.45 110.858 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -67.02 -20.12 65.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.21 110.95 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 77.9 m -84.91 -30.07 24.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 64.41 111.167 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 72.3 m -79.69 -25.01 41.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.147 -0.479 . . . . 75.34 111.193 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.68 167.35 25.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 71.44 110.836 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.11 -57.88 7.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 64.45 111.109 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.09 17.45 9.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 63.43 110.882 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.55 15.92 9.89 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.756 -0.735 . . . . 73.33 112.451 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.8 mp -112.19 137.64 50.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.894 0.378 . . . . 75.51 110.935 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 23.7 t -51.51 -30.13 19.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.178 -0.465 . . . . 73.01 110.89 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.6 t -151.45 120.47 6.68 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.176 -0.466 . . . . 73.24 111.101 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.09 151.81 4.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 75.24 110.897 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 6.4 mt -67.56 133.85 50.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.184 -0.462 . . . . 72.42 110.878 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 24.7 mt -127.03 -51.32 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 74.51 111.129 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -126.66 120.29 23.04 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.602 0.715 . . . . 75.23 110.911 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 135.08 29.52 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.677 2.251 . . . . 75.35 112.273 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.02 84.75 0.34 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 75.25 110.879 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 19.1 t -64.38 140.58 19.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 74.5 111.143 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 3.8 ptt? . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 74.5 110.882 179.968 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.816 0.341 . . . . 71.2 110.883 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.21 88.14 2.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.207 -0.451 . . . . 74.24 110.853 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -85.26 149.16 25.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.501 . . . . 73.13 110.888 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.32 128.69 16.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.14 -0.482 . . . . 74.33 110.93 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.39 158.71 18.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 73.2 110.862 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 28.2 mtt180 -58.12 -20.27 39.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.04 110.895 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -36.5 81.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 75.32 110.884 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -99.32 -24.69 14.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.463 . . . . 73.01 110.926 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -143.69 79.16 13.81 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.663 0.744 . . . . 73.05 110.828 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 -5.69 16.78 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.661 2.241 . . . . 72.34 112.394 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.7 t -92.48 27.44 2.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 71.31 111.205 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 22.8 mt -102.9 136.71 42.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.462 . . . . 63.22 110.925 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.7 t -105.65 173.49 6.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 71.15 111.172 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -49.9 -37.4 31.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 73.04 110.84 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 34.6 tp10 -60.92 -52.14 66.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 65.51 110.932 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -65.11 -51.94 58.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.07 -0.513 . . . . 74.32 110.916 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 45.5 mm -55.88 -54.35 27.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 64.52 111.122 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 50.6 m -62.85 -18.48 62.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 43.25 110.876 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -80.16 1.18 29.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 74.32 111.091 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 4.1 mtm . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.441 . . . . 73.21 110.957 179.934 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 38.1 t . . . . . 0 CA--C 1.527 0.072 0 CA-C-O 120.851 0.358 . . . . 75.44 110.828 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 65.21 149.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 72.1 110.841 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 13.5 m -62.17 125.99 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 72.43 111.172 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -140.39 82.89 1.88 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 62.54 110.879 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.575 0.702 . . . . 72.31 110.912 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.465 -0.191 0 CA-C-O 120.815 0.256 . . . . 72.53 112.381 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 41.1 p-90 -102.28 -30.39 11.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.23 110.908 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -84.93 101.1 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 74.33 110.819 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.84 -37.5 58.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 75.11 110.848 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.55 18.62 38.28 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.774 -0.727 . . . . 54.43 112.52 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.92 80.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.812 0.339 . . . . 72.01 110.93 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 16.7 mm -141.42 144.29 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 75.21 111.085 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 m -98.7 160.42 14.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.15 -0.477 . . . . 71.24 111.168 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.83 -41.05 61.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.243 -0.435 . . . . 73.21 110.827 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -69.67 -36.0 75.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.257 -0.429 . . . . 74.51 110.902 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -70.28 -41.92 72.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 71.14 110.824 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.93 -33.85 59.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 75.13 111.1 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -58.81 -52.29 66.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 74.14 110.838 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.68 -37.36 79.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 64.05 110.866 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.3 mt -55.04 -38.29 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 72.22 110.94 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -100.32 43.61 1.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.447 . . . . 72.12 110.867 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.479 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.48 -60.13 5.13 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.68 0.752 . . . . 74.34 110.929 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.0 Cg_endo -69.76 123.43 10.09 Favored 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.696 2.264 . . . . 74.1 112.311 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.85 117.89 5.36 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.693 2.262 . . . . 72.03 112.308 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.82 104.95 2.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 75.21 110.864 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.0 p -57.99 111.95 1.34 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.095 -0.502 . . . . 51.43 111.132 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.52 -6.24 6.25 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.744 -0.741 . . . . 44.01 112.55 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.73 112.62 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 74.13 110.913 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -123.96 166.55 15.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 73.53 110.915 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -162.0 136.53 6.9 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 72.12 110.903 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 86.1 t -110.05 140.35 29.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 72.54 111.101 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -153.63 146.58 24.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 72.41 110.866 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -50.79 123.92 10.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.16 -0.473 . . . . 75.25 110.899 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.4 m -59.67 113.48 2.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 75.11 110.848 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.2 m -68.55 -55.87 10.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 70.44 111.143 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -63.67 -29.26 70.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 74.24 110.934 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.405 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 1.2 m-85 -119.38 97.69 50.26 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.691 0.758 . . . . 72.33 110.884 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.6 Cg_endo -69.72 117.68 5.22 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.677 2.252 . . . . 73.34 112.347 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.61 -2.78 24.75 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.74 -0.743 . . . . 54.44 112.482 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -122.75 -176.33 3.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.866 0.365 . . . . 64.21 110.808 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -135.24 142.53 46.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 73.54 110.869 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.5 m -109.64 137.79 46.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.127 -0.488 . . . . 70.03 111.166 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.84 114.68 28.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 63.2 110.932 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.2 t -100.82 129.95 46.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 74.34 110.844 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.9 t -131.29 150.43 34.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 75.33 111.101 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.92 111.44 23.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.466 . . . . 75.2 110.828 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.02 92.38 3.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.088 -0.506 . . . . 71.23 110.876 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 66.61 30.8 8.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 74.1 110.926 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 98.25 -13.64 62.99 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.727 -0.749 . . . . 73.3 112.535 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.78 140.02 29.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.855 0.359 . . . . 74.11 110.939 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 6.7 m -101.3 105.53 17.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.266 -0.424 . . . . 63.41 111.082 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -97.11 129.67 44.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 75.03 110.855 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -106.66 124.3 49.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 73.11 110.845 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -111.96 102.98 11.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.261 -0.427 . . . . 74.01 110.95 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -59.68 140.09 56.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 71.2 110.859 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 42.2 mt -120.45 109.01 24.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.468 . . . . 74.4 111.147 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.38 130.45 40.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 75.11 110.884 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -116.74 113.51 22.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.232 -0.44 . . . . 75.03 110.886 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -146.26 136.89 24.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 74.4 110.829 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.15 35.85 23.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 75.1 111.043 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.32 30.53 15.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.269 -0.423 . . . . 62.31 110.829 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -130.6 138.28 50.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 75.51 110.933 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mp -101.16 150.47 22.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 74.43 110.915 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -168.38 134.97 1.96 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.827 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 51.8 mt -113.32 -40.66 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 72.22 111.107 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 15.9 p30 -84.49 -5.64 59.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 64.21 110.919 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 61.57 16.29 7.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.11 110.853 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -125.36 -8.15 6.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 73.44 110.897 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 6.0 t -144.35 104.5 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 72.21 111.102 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -94.76 146.77 23.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.148 -0.478 . . . . 73.34 110.902 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -117.33 176.15 5.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 63.44 110.911 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -100.44 -14.56 18.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 73.12 110.861 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -167.05 171.87 10.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 74.34 110.918 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.49 -22.72 58.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.15 -0.477 . . . . 72.03 110.907 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.2 ttt -61.58 -56.76 16.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 60.12 110.912 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -67.18 -36.3 81.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 70.33 110.943 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.26 -53.15 59.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 73.32 110.931 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 65.3 t -62.2 -36.74 76.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 61.25 111.14 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -54.78 -39.76 68.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.069 -0.514 . . . . 74.23 110.933 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -71.75 -49.01 42.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.13 -0.486 . . . . 73.24 110.838 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -62.92 -23.67 67.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.233 -0.44 . . . . 71.34 110.939 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.1 m -83.96 -29.47 27.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.082 -0.508 . . . . 65.21 111.155 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 42.3 m -77.65 -23.52 49.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 71.11 111.164 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -165.24 160.17 18.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.205 -0.452 . . . . 71.44 110.857 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.91 -58.12 6.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 72.34 111.157 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 21.5 t70 55.87 25.11 8.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 71.22 110.834 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 118.73 -10.86 12.29 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.792 -0.718 . . . . 53.23 112.441 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 10.8 mp -87.21 138.66 31.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.87 0.367 . . . . 74.34 110.85 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 18.4 p -54.6 -26.31 31.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 71.13 110.936 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 9.2 t -157.54 124.98 5.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.133 -0.485 . . . . 74.51 111.128 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -52.66 147.9 7.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 75.34 110.815 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.5 mt -65.93 138.83 58.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.1 -0.5 . . . . 75.31 110.915 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 24.9 mt -127.16 -51.29 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 75.21 111.094 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -129.93 122.25 20.3 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.531 0.681 . . . . 74.23 110.873 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.86 138.95 38.69 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.689 2.259 . . . . 73.53 112.287 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 84.13 0.42 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 74.42 110.85 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 15.2 m -64.37 130.75 29.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 53.43 111.12 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 75.15 110.845 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.764 0.316 . . . . 73.41 110.876 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.4 m -100.47 88.74 3.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 72.31 110.894 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -83.53 147.27 27.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 73.32 110.97 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.1 128.82 21.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.114 -0.493 . . . . 73.35 110.937 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.87 156.09 19.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 73.55 110.893 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -60.85 -18.0 53.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.853 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.2 -39.05 86.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 74.43 110.848 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -92.5 -20.49 20.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.878 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -148.84 81.36 7.71 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.674 0.749 . . . . 74.45 110.902 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -6.84 19.53 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.711 2.274 . . . . 74.44 112.374 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.3 t -94.13 27.3 2.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.205 -0.452 . . . . 74.11 111.097 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 62.2 mt -100.4 136.7 39.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.264 -0.425 . . . . 74.01 110.914 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 7.2 t -93.82 152.99 18.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.454 . . . . 74.52 111.142 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -49.1 -31.83 8.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 65.23 110.9 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.77 -54.97 40.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 71.54 110.881 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' B' ' 310' ' ' ILE . 0.3 OUTLIER -57.15 -32.41 66.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 73.51 110.935 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . 0.419 ' N ' ' HG3' ' B' ' 309' ' ' GLU . 27.0 mm -63.31 -53.2 48.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 74.55 111.099 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.33 -21.26 63.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 73.31 110.868 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -76.88 -3.13 37.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.499 . . . . 62.04 111.139 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 2.6 mtm . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.822 179.979 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 43.9 t . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.837 0.351 . . . . 40.3 110.812 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 65.94 145.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 71.41 110.86 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 6.7 m -56.63 116.29 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 64.52 111.139 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -125.21 74.89 1.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 75.35 110.88 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 13.3 mtmt . . . . . 0 C--N 1.328 -0.348 0 CA-C-O 121.652 0.739 . . . . 74.51 110.919 179.906 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.159 0 CA-C-O 120.784 0.243 . . . . 75.25 112.323 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 34.2 p-90 -101.51 -30.9 11.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 73.24 110.908 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -87.32 99.48 12.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 75.12 110.851 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -75.71 -33.64 60.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 74.13 110.909 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.95 19.59 37.93 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.738 -0.744 . . . . 74.13 112.449 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.08 82.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.77 0.319 . . . . 75.51 110.919 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 29.5 mm -146.8 145.04 19.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 72.23 111.158 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.2 p -101.14 177.34 4.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 71.31 111.096 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -41.08 97.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 72.01 110.82 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -62.91 -38.26 90.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 72.54 110.938 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -36.23 60.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.105 -0.498 . . . . 63.03 110.962 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.41 -33.83 67.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 75.33 111.101 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -68.69 -53.14 24.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 64.24 110.878 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.17 -40.03 96.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 71.14 110.856 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.9 mt -58.63 -38.2 77.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 73.42 110.911 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -101.42 43.36 1.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 75.42 110.852 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.481 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.29 -60.13 4.39 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.68 0.752 . . . . 72.35 110.902 179.924 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.4 Cg_endo -69.72 124.08 10.75 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.615 2.21 . . . . 73.44 112.445 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 116.92 4.78 Favored 'Trans proline' 0 C--O 1.23 0.124 0 C-N-CA 122.704 2.269 . . . . 62.1 112.325 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -154.79 110.58 3.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 74.23 110.863 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.1 p -62.71 111.8 2.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 65.32 111.114 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.76 -7.07 6.17 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.74 -0.743 . . . . 72.12 112.443 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 3.0 tp -89.51 111.59 22.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 73.54 110.969 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -123.31 167.7 13.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.213 -0.449 . . . . 74.42 110.885 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.45 134.02 5.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 65.12 110.873 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.2 t -110.03 140.04 30.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 74.51 111.067 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.5 151.65 29.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 75.33 110.884 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -51.38 124.24 11.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 73.53 110.904 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.6 m -59.17 112.05 1.57 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 53.1 110.86 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.3 m -68.77 -56.46 7.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 65.45 111.126 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -67.26 -24.99 65.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 71.11 110.915 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -116.42 95.43 45.51 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.69 0.757 . . . . 75.45 110.896 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 110.52 2.58 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.66 2.24 . . . . 63.24 112.353 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.7 6.31 21.41 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.707 -0.759 . . . . 71.02 112.461 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -132.44 -177.81 4.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.797 0.332 . . . . 73.54 110.841 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -129.01 155.83 44.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 73.53 110.88 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.9 m -125.84 139.94 53.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.07 -0.514 . . . . 75.14 111.123 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.71 115.01 26.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.197 -0.456 . . . . 75.14 110.931 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.6 t -100.83 126.97 47.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.42 110.889 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.4 t -127.81 153.28 36.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 74.41 111.127 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -104.24 111.76 24.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.461 . . . . 72.03 110.823 -179.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.47 92.37 3.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 74.42 110.844 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 66.95 31.25 7.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 65.02 110.89 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.71 -14.48 62.99 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.739 -0.743 . . . . 74.11 112.511 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -87.56 143.38 27.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.796 0.331 . . . . 75.24 110.916 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 9.9 m -103.8 112.97 39.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 71.41 111.12 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.5 pm0 -105.54 126.56 52.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 70.41 110.913 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -103.33 126.46 50.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.171 -0.468 . . . . 73.54 110.854 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -110.49 116.17 30.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 72.1 110.87 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.04 136.92 50.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.102 -0.499 . . . . 75.23 110.885 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 81.2 mt -118.61 109.28 26.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 74.42 111.101 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.11 130.41 39.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 73.42 110.853 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -114.09 116.67 29.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.878 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -150.35 136.07 18.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 72.32 110.852 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.11 35.93 23.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.198 -0.456 . . . . 60.13 111.108 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.71 29.98 14.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 71.45 110.889 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -129.29 142.24 50.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 72.13 110.887 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.1 mp -106.09 148.62 27.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 71.53 110.966 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.2 t -166.95 131.29 1.97 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.226 -0.443 . . . . 74.53 110.899 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 41.0 mt -107.48 -32.25 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 74.23 111.13 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -86.59 -1.17 57.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 71.3 110.845 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 60.64 17.85 7.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 60.02 110.849 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -132.46 -38.43 1.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 71.44 110.961 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.0 t -104.49 104.55 17.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.075 -0.511 . . . . 74.22 111.109 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -98.78 146.02 26.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.18 -0.463 . . . . 75.2 110.95 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -116.71 178.25 4.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 73.15 110.895 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.5 -15.87 17.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.173 -0.467 . . . . 74.2 110.905 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -165.81 171.89 12.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 74.21 110.869 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.05 -22.8 58.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 73.34 110.909 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -56.76 13.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 74.25 110.875 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -65.86 -35.2 79.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 72.31 110.913 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.35 -52.69 62.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 71.41 110.975 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 75.0 t -62.67 -36.61 76.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 73.13 111.126 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -55.02 -39.29 68.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.117 -0.492 . . . . 74.34 110.887 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.97 -45.99 58.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 74.34 110.887 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -65.63 -23.68 66.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 70.41 110.99 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 87.3 m -84.14 -28.94 27.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 74.41 111.131 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 29.1 m -77.67 -26.21 50.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 72.43 111.163 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -165.03 162.85 20.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 71.34 110.892 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.99 -58.4 6.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 65.12 111.126 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 32.0 t70 57.93 21.69 7.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 75.43 110.876 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.27 7.33 21.11 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.803 -0.713 . . . . 63.42 112.518 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 7.8 mp -100.66 138.92 37.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.787 0.327 . . . . 74.52 110.959 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 36.1 t -51.35 -30.8 19.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 43.04 110.889 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 9.5 t -158.47 126.17 5.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 75.32 111.184 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -51.69 152.41 2.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 71.43 110.823 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 9.9 mt -74.33 139.04 43.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 63.02 110.847 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 26.1 mt -127.14 -51.18 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 65.11 111.124 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -130.19 119.44 18.69 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.596 0.712 . . . . 73.43 110.831 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 140.76 43.39 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.716 2.277 . . . . 72.32 112.287 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.65 83.76 0.44 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.163 -0.472 . . . . 71.2 110.899 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 30.2 m -64.45 126.28 22.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 74.31 111.154 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.4 mtm . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 72.35 110.894 179.949 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.832 0.348 . . . . 72.22 110.895 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.74 91.07 8.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 72.3 110.865 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -79.85 149.59 30.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 73.43 110.907 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -144.34 129.18 18.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.067 -0.515 . . . . 72.33 110.944 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.89 158.37 15.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 74.51 110.905 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -62.75 -16.64 58.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.181 -0.463 . . . . 75.05 110.871 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -39.28 90.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 71.25 110.852 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -90.61 -25.38 20.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 64.13 110.812 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -147.03 84.97 7.14 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.627 0.727 . . . . 72.54 110.882 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.76 -6.6 19.0 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.699 2.266 . . . . 75.15 112.367 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.2 t -94.39 27.36 2.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 74.22 111.149 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 57.3 mt -101.11 136.83 40.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 72.22 110.879 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 10.1 t -92.02 152.89 19.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 73.25 111.116 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -49.89 -31.2 11.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 75.54 110.895 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -54.07 50.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 74.41 110.865 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . 0.412 ' HG3' ' N ' ' B' ' 310' ' ' ILE . 0.3 OUTLIER -58.92 -32.45 69.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 74.33 110.91 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . 0.412 ' N ' ' HG3' ' B' ' 309' ' ' GLU . 30.5 mm -62.08 -53.67 44.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.152 -0.476 . . . . 71.24 111.076 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 1.1 p -56.9 -30.78 64.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 71.43 110.926 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -64.39 -15.14 59.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.513 . . . . 64.44 111.108 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.6 mtm . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 74.2 110.925 179.95 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 120.843 0.354 . . . . 74.45 110.829 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.3 156.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 72.34 110.837 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 5.7 m -51.41 130.09 11.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.06 -0.518 . . . . 72.31 111.138 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -145.76 75.01 1.41 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.192 -0.458 . . . . 72.43 110.891 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-O 121.593 0.711 . . . . 73.42 110.879 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo . . . . . 0 N--CA 1.466 -0.127 0 CA-C-O 120.79 0.246 . . . . 63.42 112.406 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 47.6 p-90 -54.83 -25.75 30.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 71.34 110.919 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -90.66 99.26 12.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 75.22 110.899 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -75.96 -41.99 49.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.106 -0.497 . . . . 75.11 110.906 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.54 25.39 55.17 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.731 -0.747 . . . . 72.03 112.541 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.4 65.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 74.0 110.875 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.8 mm -136.06 145.25 31.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 74.2 111.084 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.9 p -97.48 177.09 5.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 74.21 111.15 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -65.98 -39.46 90.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 74.2 110.822 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.92 -37.63 88.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.261 -0.427 . . . . 71.32 110.897 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.01 -37.83 58.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.506 . . . . 73.53 110.904 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.57 -33.98 67.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 65.2 111.118 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -67.14 -53.14 33.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 72.03 110.886 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -40.06 94.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 75.01 110.896 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.6 mt -56.41 -38.85 72.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 73.22 110.95 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -99.48 43.26 1.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 64.44 110.902 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.483 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.11 -60.04 4.62 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.717 0.77 . . . . 72.43 110.891 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.5 Cg_endo -69.79 123.99 10.63 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.728 2.286 . . . . 64.35 112.315 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.65 117.69 5.23 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.706 2.27 . . . . 74.23 112.38 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -155.12 103.67 2.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 74.25 110.841 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -57.33 111.83 1.21 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 72.53 111.116 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.34 -8.92 5.93 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.761 -0.733 . . . . 42.2 112.523 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.6 tp -88.07 111.89 22.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.891 0.377 . . . . 71.21 110.875 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 25.7 p90 -123.54 165.31 17.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 74.43 110.888 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -161.58 137.34 7.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.478 . . . . 71.41 110.883 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 91.1 t -109.52 129.91 63.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.221 -0.445 . . . . 72.55 111.15 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.91 137.93 29.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 71.04 110.946 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.4 126.96 18.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.45 . . . . 73.15 110.935 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.0 m -55.57 114.01 1.68 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.794 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 m -70.07 -49.16 53.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.135 -0.484 . . . . 64.34 111.098 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -80.16 -3.17 47.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 72.31 110.932 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -139.48 88.6 12.52 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.615 0.721 . . . . 72.13 110.897 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 122.29 8.98 Favored 'Trans proline' 0 C--N 1.34 0.117 0 C-N-CA 122.679 2.252 . . . . 71.24 112.341 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.87 -8.21 23.62 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.714 -0.755 . . . . 73.45 112.567 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -127.94 -179.64 5.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.759 0.314 . . . . 65.3 110.9 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -130.86 164.33 25.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 73.24 110.94 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 97.3 m -143.87 128.16 17.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 74.25 111.138 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.31 132.75 42.74 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.272 -0.422 . . . . 74.13 110.917 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 5.8 m -113.02 126.54 55.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.166 -0.47 . . . . 74.44 110.908 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.3 t -126.61 152.37 34.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 74.11 111.116 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -104.66 111.9 24.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 73.12 110.87 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -115.26 93.04 4.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 53.11 110.911 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 66.68 31.03 7.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 73.32 110.887 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.31 -12.87 65.0 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.79 -0.719 . . . . 53.11 112.491 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.18 139.91 30.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.805 0.336 . . . . 73.52 110.906 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 92.6 t -99.93 111.21 28.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.24 -0.436 . . . . 73.13 111.21 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -102.89 129.9 49.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 74.1 110.866 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -105.36 127.28 52.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 74.5 110.824 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -113.71 111.11 21.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.29 -0.414 . . . . 72.34 110.93 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -63.32 137.16 58.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.066 -0.516 . . . . 65.31 110.841 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 54.3 mt -119.66 109.43 26.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.139 -0.482 . . . . 74.23 111.132 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -84.63 121.4 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.954 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -110.5 98.11 7.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.327 -0.397 . . . . 72.21 111.013 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -132.03 142.65 49.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.463 . . . . 73.45 110.844 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.55 35.95 26.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 62.11 111.165 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 12.5 t 61.31 30.12 18.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 74.45 110.812 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -135.57 143.56 45.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.466 . . . . 75.24 110.942 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.0 mp -106.37 149.8 26.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 63.32 110.966 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.27 140.82 5.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 72.45 110.836 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 49.8 mt -115.61 -34.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 73.34 111.148 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . 0.424 ' O ' ' CG ' ' A' ' 142' ' ' GLU . 31.6 p-10 -96.65 11.53 35.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 71.24 110.875 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 6.6 pt-20 45.76 30.73 0.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 74.1 110.898 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -131.88 -39.96 1.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.112 -0.494 . . . . 74.21 110.906 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.6 p -116.6 104.51 16.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 74.01 111.087 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -93.0 148.91 21.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 75.21 110.957 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -119.4 177.71 4.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 64.14 110.821 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -100.52 -15.52 17.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 72.42 110.919 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -165.81 172.12 12.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 70.24 110.883 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -22.57 59.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 73.21 110.912 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.2 ttp -62.73 -57.0 12.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.471 . . . . 75.51 110.84 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -66.17 -35.56 80.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.948 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.45 -49.9 71.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 74.45 110.923 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 73.8 t -64.01 -38.19 81.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.183 -0.462 . . . . 74.14 111.192 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.84 -38.17 67.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.11 -0.495 . . . . 63.32 110.926 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.24 -46.1 57.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 71.53 110.888 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -70.86 -11.28 60.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.217 -0.447 . . . . 73.33 110.938 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.4 m -92.2 -32.43 15.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.105 -0.498 . . . . 64.43 111.128 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 5.7 t -80.35 -25.64 39.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.304 -0.407 . . . . 71.51 111.078 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -157.53 158.06 34.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.304 -0.407 . . . . 75.34 110.853 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.89 -56.48 12.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 72.43 111.103 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 58.12 22.63 9.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 74.41 110.846 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.28 11.17 18.65 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.752 . . . . 71.02 112.466 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -105.62 134.5 48.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.928 0.394 . . . . 72.23 110.943 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 23.5 t -51.71 -29.71 19.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.148 -0.478 . . . . 73.34 110.849 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 3.0 t -153.03 120.44 5.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 70.5 111.116 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -53.54 143.0 20.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 73.5 110.913 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.7 mt -61.56 135.58 57.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 74.33 110.888 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 27.0 mt -127.19 -51.41 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 74.24 111.117 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.4 120.04 22.01 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.605 0.717 . . . . 74.32 110.841 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 133.83 26.48 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.699 2.266 . . . . 73.42 112.302 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.94 83.67 0.49 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 74.32 110.883 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.8 m -64.55 144.97 14.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 74.43 111.173 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 7.8 ptm . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 71.34 110.886 179.92 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.845 0.355 . . . . 62.42 110.915 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 3.3 t -110.17 88.4 2.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 75.35 110.883 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -83.46 149.43 26.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.211 -0.45 . . . . 74.33 110.975 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.71 129.39 10.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 75.54 110.891 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.25 170.89 9.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.209 -0.45 . . . . 55.13 110.888 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -63.8 -15.58 59.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 72.31 110.914 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.47 -38.58 91.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 73.34 110.848 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -104.08 -26.14 12.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.876 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -138.33 77.8 34.68 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.594 0.712 . . . . 64.32 110.897 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.73 -6.15 17.89 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.674 2.249 . . . . 64.12 112.308 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.3 t -93.64 27.27 2.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.434 . . . . 75.42 111.069 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 36.0 mt -103.11 136.65 42.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.269 -0.423 . . . . 72.5 110.997 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.7 t -107.12 173.69 6.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.438 . . . . 72.34 111.171 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 26.8 pt-20 -49.26 -37.63 24.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 72.32 110.793 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -61.38 -52.0 66.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 74.31 110.916 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -63.29 -52.45 61.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 63.42 110.878 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 46.2 mm -56.33 -54.06 32.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.468 . . . . 74.11 111.098 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 22.8 t -60.33 -19.92 57.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 75.31 110.882 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.0 3.0 28.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.092 -0.504 . . . . 71.32 111.102 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.8 mtm . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 64.12 110.887 179.997 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 16.2 t . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.882 0.372 . . . . 74.12 110.838 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.44 139.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.475 . . . . 71.12 110.87 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 5.6 m -50.93 122.24 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 73.42 111.188 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -131.85 80.88 1.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.932 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.599 0.714 . . . . 74.41 110.917 179.928 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.466 -0.124 0 CA-C-O 120.764 0.235 . . . . 73.31 112.324 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 47.1 p-90 -54.54 -27.18 36.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.251 -0.431 . . . . 75.12 110.899 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -87.45 99.48 12.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 64.41 110.997 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.6 -39.62 57.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.16 -0.473 . . . . 75.3 110.914 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.65 23.91 38.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.788 -0.72 . . . . 71.0 112.557 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.53 70.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.798 0.332 . . . . 75.34 110.913 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.4 mm -138.95 145.14 28.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.425 . . . . 74.31 111.152 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.7 p -97.4 177.17 5.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.21 -0.45 . . . . 73.34 111.154 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -39.33 89.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.221 -0.445 . . . . 74.1 110.919 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -64.04 -37.54 87.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 71.22 110.884 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -38.57 56.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 75.13 110.94 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.27 -36.45 79.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 71.13 111.044 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.61 -53.15 30.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 74.32 110.88 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.99 -34.51 78.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 73.14 110.876 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.29 -35.69 81.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 73.31 110.89 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -104.89 43.74 1.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 73.51 110.91 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.481 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.45 -59.94 5.37 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.604 0.716 . . . . 72.45 110.919 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.0 Cg_endo -69.81 122.66 9.32 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.647 2.232 . . . . 75.33 112.307 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 117.61 5.19 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.66 2.24 . . . . 75.01 112.369 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -154.99 103.48 2.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.196 -0.456 . . . . 75.32 110.938 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 10.8 p -56.14 111.93 1.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.456 . . . . 73.32 111.186 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.54 -10.8 5.79 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.77 -0.728 . . . . 74.23 112.546 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -87.8 111.83 21.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.329 . . . . 74.5 110.923 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -123.79 162.09 23.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 73.23 110.889 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.65 136.58 11.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.117 -0.492 . . . . 74.34 110.985 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.6 t -109.6 139.54 32.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 72.41 111.23 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.91 144.55 24.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 74.44 110.805 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.74 124.05 10.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 73.3 110.926 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.3 m -59.47 118.75 6.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 74.34 110.941 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.8 m -68.65 -56.38 8.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 75.02 111.215 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -70.49 -29.21 65.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.11 110.915 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -107.88 92.72 9.42 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.665 0.745 . . . . 75.35 110.878 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 112.94 3.22 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.612 2.208 . . . . 73.23 112.399 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.54 -4.84 24.72 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.699 -0.763 . . . . 64.23 112.499 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -121.17 -178.9 3.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.824 0.345 . . . . 72.23 110.857 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -125.52 171.5 10.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.431 . . . . 74.2 110.94 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 99.2 m -139.42 122.82 17.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 74.51 111.126 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.43 112.49 25.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 72.33 110.89 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 42.9 t -101.33 124.14 46.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 65.33 110.879 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.8 t -121.75 150.21 25.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 72.45 111.115 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.25 110.82 23.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 72.31 110.895 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.04 90.35 3.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.127 -0.488 . . . . 64.43 110.937 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 66.1 32.78 7.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 74.32 110.856 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.48 -13.8 63.93 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.758 -0.734 . . . . 72.51 112.507 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -87.89 146.39 25.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.835 0.35 . . . . 74.5 110.9 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 5.8 m -106.53 104.13 16.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.216 -0.447 . . . . 73.01 111.13 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -89.47 112.69 23.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 72.43 110.884 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -92.6 124.85 36.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 73.1 110.846 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -118.36 106.71 13.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 74.31 110.93 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 6.7 ttp-105 -70.23 136.77 50.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.056 -0.52 . . . . 71.15 110.863 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 58.2 mt -110.83 108.42 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 75.5 111.153 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.65 124.79 26.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 74.44 110.937 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -109.53 104.52 13.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 72.44 110.951 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -144.26 143.25 30.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.477 . . . . 75.24 110.913 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 60.39 39.93 18.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 63.22 111.128 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 56.87 24.09 8.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.254 -0.43 . . . . 72.43 110.843 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 7.3 mtmm -131.47 162.94 29.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.135 -0.484 . . . . 74.23 110.917 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.1 mt -124.52 148.57 47.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.214 -0.448 . . . . 75.43 110.943 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 7.2 t -166.44 145.75 5.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 64.33 110.908 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 56.1 mt -115.58 -28.75 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 74.32 111.123 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . 0.441 ' O ' ' CG ' ' A' ' 142' ' ' GLU . 4.3 p30 -101.25 12.76 36.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 73.04 110.906 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.441 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 7.1 pt-20 46.9 27.93 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 71.31 110.906 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -133.12 -37.77 0.97 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.49 . . . . 65.15 110.899 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 1.4 t -110.65 104.64 17.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.092 -0.503 . . . . 74.13 111.077 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -97.56 138.05 35.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 72.44 110.97 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -114.43 176.52 5.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 72.01 110.909 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.58 -14.58 18.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 71.54 110.904 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -165.51 172.18 12.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 72.11 110.899 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.63 -22.4 58.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 73.12 110.91 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -62.73 -57.12 12.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 73.24 110.896 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.53 -36.3 83.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 71.32 110.976 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.21 -53.22 58.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 73.35 110.932 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 67.2 t -60.77 -37.52 76.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 75.25 111.11 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -55.06 -39.02 68.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 75.23 110.832 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -71.78 -46.54 57.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 75.21 110.884 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -66.37 -21.23 66.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 75.12 110.885 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 92.0 m -84.18 -31.28 25.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 73.13 111.131 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 61.7 m -78.29 -24.42 46.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 74.4 111.137 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -165.64 157.84 14.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 74.01 110.885 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.26 -58.26 6.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 70.31 111.089 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 53.92 27.54 7.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 71.51 110.855 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 118.88 3.99 13.13 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 53.41 112.509 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 9.5 mp -106.67 140.95 38.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 74.45 110.871 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 18.2 p -54.44 -26.38 30.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 72.0 110.885 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 9.0 t -162.64 129.55 3.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 74.41 111.105 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -53.13 161.39 0.86 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 74.34 110.777 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 10.4 mt -79.21 141.41 37.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 65.42 110.886 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 23.1 mt -127.18 -51.4 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 75.21 111.167 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.6 mtpt -130.13 123.18 20.59 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.577 0.703 . . . . 74.05 110.937 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 138.3 37.6 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.721 2.281 . . . . 72.4 112.303 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.1 83.62 0.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 73.12 110.931 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 21.1 t -64.2 136.9 25.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 73.34 111.089 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.6 ptt? . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 75.35 110.87 179.888 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.872 0.367 . . . . 74.15 110.918 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 6.0 t -102.65 88.83 3.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 74.44 110.852 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -83.75 147.82 27.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.109 -0.496 . . . . 74.12 110.942 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -145.56 129.14 17.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.071 -0.513 . . . . 74.12 110.858 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.52 162.16 16.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 73.21 110.917 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -62.2 -16.89 56.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 75.23 110.838 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -36.88 84.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.434 . . . . 74.22 110.882 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -98.32 -19.98 17.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.489 . . . . 73.24 110.87 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -149.39 79.73 8.02 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.559 0.695 . . . . 63.54 110.791 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 -6.6 18.98 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.754 2.303 . . . . 73.43 112.315 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.6 t -94.11 27.27 2.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.44 . . . . 65.2 111.102 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 48.6 mt -100.24 136.92 39.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.225 -0.443 . . . . 70.41 110.933 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 12.0 t -107.75 174.53 5.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 61.52 111.133 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -50.07 -37.86 35.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.212 -0.449 . . . . 75.21 110.84 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -60.95 -49.71 76.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 74.54 110.925 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -66.69 -51.95 50.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.159 -0.473 . . . . 73.41 110.945 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 44.6 mm -56.05 -53.75 35.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.119 -0.491 . . . . 72.15 111.094 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 82.8 p -59.8 -25.24 64.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 74.31 110.806 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -77.98 -2.66 38.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.48 . . . . 74.2 111.071 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 71.33 110.895 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.863 0.363 . . . . 73.11 110.871 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.29 155.65 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 74.42 110.865 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 4.7 m -51.38 121.31 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 72.2 111.13 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -135.92 74.96 1.53 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 65.12 110.797 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 22.1 mttt . . . . . 0 C--N 1.33 -0.275 0 CA-C-O 121.63 0.729 . . . . 74.03 110.875 179.893 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 C--O 1.231 0.167 0 CA-C-O 120.796 0.248 . . . . 64.23 112.348 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 45.0 p-90 -100.09 -28.25 13.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 75.33 110.902 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -83.55 102.19 11.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.418 . . . . 75.42 110.888 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -75.57 -38.65 59.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 64.23 110.818 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 59.27 18.14 41.38 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.719 -0.753 . . . . 72.24 112.494 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.96 80.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.68 0.276 . . . . 72.52 110.871 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.5 mm -145.82 145.41 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.321 -0.399 . . . . 74.52 111.181 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -100.21 176.85 5.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 72.02 111.156 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -43.29 97.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.22 -0.446 . . . . 71.21 110.865 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.31 -37.74 78.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 73.21 110.871 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -38.24 55.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 73.03 110.847 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.21 -38.47 85.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 71.52 111.106 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.88 -52.45 50.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 72.33 110.858 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -33.64 76.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 74.24 110.862 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 11.7 mt -60.74 -38.0 83.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 74.54 110.92 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 8.1 mp -105.77 43.18 1.15 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 73.12 110.891 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.483 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -61.39 -59.83 12.37 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.649 0.738 . . . . 74.42 110.917 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.77 124.2 10.85 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.695 2.263 . . . . 74.33 112.355 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.79 111.06 2.71 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.694 2.263 . . . . 75.34 112.273 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -148.99 123.28 9.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 72.33 110.954 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.97 111.66 8.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 71.42 111.174 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.79 -7.81 6.13 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.786 -0.721 . . . . 74.35 112.47 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -87.4 111.63 21.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.852 0.358 . . . . 72.31 110.98 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -125.33 160.17 29.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 74.4 110.839 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.09 134.71 11.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.112 -0.495 . . . . 73.32 110.92 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 91.9 t -109.52 141.22 25.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.171 -0.468 . . . . 63.31 111.101 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -153.58 149.94 28.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.474 . . . . 74.43 110.826 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.81 124.28 10.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.917 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.6 t -57.32 104.93 0.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 71.15 110.817 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.7 m -68.68 -30.04 68.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 51.43 111.083 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.93 -30.55 61.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 65.42 110.928 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -139.64 116.09 8.3 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.636 0.731 . . . . 75.25 110.895 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 122.17 8.86 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.676 2.25 . . . . 70.03 112.349 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.4 -9.73 24.27 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.708 -0.758 . . . . 55.33 112.54 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -114.53 175.47 5.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.341 . . . . 62.24 110.871 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -132.57 146.55 51.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 73.43 110.911 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 3.3 m -116.71 138.84 51.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 74.12 111.097 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -112.82 115.93 29.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.48 . . . . 73.32 110.919 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.4 m -99.87 120.17 39.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.261 -0.427 . . . . 61.41 110.875 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.4 t -121.99 146.97 26.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 71.31 111.174 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.43 110.45 22.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.229 -0.442 . . . . 75.13 110.794 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.1 98.05 6.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.092 -0.504 . . . . 75.44 110.904 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 66.22 28.29 10.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 75.01 110.86 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.35 -14.91 63.0 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.77 -0.729 . . . . 44.43 112.512 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt -87.58 139.03 30.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.342 . . . . 75.21 110.986 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 11.0 m -99.67 109.68 25.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 74.12 111.124 179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -100.98 130.74 47.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 74.33 110.826 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -105.9 131.47 53.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 72.05 110.852 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -115.94 115.74 26.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 75.31 110.892 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -70.55 125.29 26.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.52 . . . . 71.41 110.865 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 79.6 mt -107.07 108.9 26.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 72.32 111.172 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 4.2 ttt -76.27 129.44 36.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.111 -0.495 . . . . 73.2 110.792 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -111.89 116.65 30.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 74.13 110.926 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -151.11 135.99 17.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.488 . . . . 72.5 110.846 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.02 35.89 23.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.52 111.126 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.5 27.16 15.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 70.34 110.873 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.73 136.07 51.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 74.44 110.895 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.2 mp -101.52 150.15 23.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.174 -0.466 . . . . 74.11 110.89 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 53.3 p -167.95 131.81 1.68 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 73.24 110.895 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 60.7 mt -105.8 -33.5 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 73.31 111.117 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -85.24 -0.36 54.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 74.51 110.869 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 60.53 17.72 7.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 62.51 110.889 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -132.53 -38.55 1.03 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 74.1 110.932 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.8 t -101.99 104.5 16.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.1 -0.5 . . . . 72.44 111.166 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -99.87 143.38 30.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 73.41 110.975 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -115.82 174.56 5.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 74.02 110.909 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -100.87 -3.52 29.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 73.22 110.888 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -176.51 157.87 1.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 74.4 110.879 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.3 mp -59.18 -44.08 92.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 70.52 110.953 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -36.25 36.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 74.42 110.858 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -75.21 -45.49 40.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 75.23 110.941 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.83 -42.52 75.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 62.42 110.961 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 75.5 t -66.6 -43.36 90.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 72.11 111.13 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -52.97 -37.34 61.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 64.22 110.915 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -72.3 -47.6 48.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 72.3 110.81 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -68.35 -15.59 63.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 73.14 110.943 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.3 m -86.76 -33.98 19.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.079 -0.51 . . . . 71.54 111.135 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 3.9 m -78.08 -25.37 47.6 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 55.14 111.076 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -157.5 161.67 38.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.244 -0.434 . . . . 74.22 110.853 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.65 -54.49 22.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 70.24 111.092 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 59.81 20.46 9.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 71.35 110.868 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 109.18 12.19 20.53 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.713 -0.756 . . . . 53.44 112.397 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.3 mp -105.89 136.93 44.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.794 0.331 . . . . 75.34 110.965 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 11.5 t -51.57 -29.69 18.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 74.25 110.812 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.9 t -152.67 120.24 6.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 64.01 111.118 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -50.97 146.1 6.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 75.05 110.901 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.0 mt -63.48 132.17 50.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 71.23 110.898 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 23.9 mt -126.97 -51.39 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 73.41 111.184 179.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.3 mttm -123.87 119.25 26.83 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.54 0.686 . . . . 74.32 110.843 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 134.78 28.89 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.742 2.295 . . . . 55.24 112.362 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.99 84.46 0.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 71.13 110.898 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.7 m -64.42 129.89 28.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.221 -0.445 . . . . 73.53 111.153 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.6 mtt . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.24 -0.436 . . . . 71.1 110.914 179.861 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.856 0.36 . . . . 73.14 110.983 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 6.2 t -82.95 89.07 6.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 75.32 110.868 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -79.95 148.42 31.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 75.21 110.917 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.21 128.53 13.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 74.2 110.935 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 20.3 m -89.57 162.14 15.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.292 -0.413 . . . . 70.44 110.888 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -59.33 -19.8 49.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 74.12 110.857 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -36.7 82.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 74.53 110.852 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -102.58 -10.56 19.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 74.14 110.933 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -157.58 78.6 3.56 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.662 0.744 . . . . 74.32 110.937 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.64 -6.7 19.17 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.77 2.314 . . . . 75.12 112.351 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 15.2 t -93.74 27.54 2.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.213 -0.449 . . . . 74.13 111.168 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 44.0 mt -101.74 138.25 38.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 75.41 110.955 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 10.8 t -107.52 172.97 6.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 74.52 111.132 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -50.09 -31.98 14.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.451 . . . . 62.15 110.967 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.72 -45.8 77.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.099 -0.501 . . . . 75.4 110.87 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -70.31 -51.67 28.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 65.1 110.872 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 40.5 mm -55.72 -53.09 41.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 74.4 111.189 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 35.0 t -63.97 -25.62 68.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 72.21 110.879 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -71.16 -9.75 58.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 74.11 111.144 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 72.3 110.902 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 86.1 p . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.902 0.382 . . . . 73.23 110.902 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 65.54 147.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 75.14 110.857 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 12.3 m -51.23 116.84 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.084 -0.507 . . . . 74.41 111.164 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -125.24 75.04 1.42 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 64.53 110.839 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.616 0.722 . . . . 74.14 110.875 179.904 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 CA-C-O 121.428 0.46 . . . . 73.2 112.477 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -44.99 1.8 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.685 2.257 . . . . 54.34 112.36 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.55 39.73 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.457 . . . . 71.41 110.917 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.08 -100.72 0.28 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.712 -0.756 . . . . 50.32 112.485 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 77.7 p -164.29 64.5 0.15 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.832 0.348 . . . . 74.41 110.871 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -126.32 68.59 66.71 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.652 0.739 . . . . 74.25 110.873 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -33.14 17.42 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.731 2.287 . . . . 75.32 112.319 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 48.9 p-90 -54.86 -26.32 34.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 64.42 110.915 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -89.17 100.55 13.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.27 -0.423 . . . . 71.11 110.885 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 -75.62 -37.06 60.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 75.54 110.834 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 56.24 20.56 29.27 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.703 -0.76 . . . . 72.14 112.501 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.32 79.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.684 0.278 . . . . 65.14 110.857 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 24.4 mm -144.19 144.82 22.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 75.43 111.076 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 p -96.57 177.08 5.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 62.4 111.167 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -66.03 -39.04 89.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.278 -0.419 . . . . 73.55 110.811 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -69.59 -34.75 74.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 71.3 110.893 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -36.63 61.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 74.43 110.899 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.06 -34.0 61.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 73.12 111.028 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.24 -53.4 37.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.234 -0.439 . . . . 70.43 110.855 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.87 -39.17 93.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 75.31 110.916 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 17.3 mt -57.5 -38.44 74.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 74.41 110.913 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -101.89 43.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 75.3 110.931 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.472 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.93 -60.35 4.48 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.674 0.75 . . . . 75.34 110.982 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.472 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.71 123.13 9.82 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.735 2.29 . . . . 75.34 112.341 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 118.08 5.47 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.713 2.275 . . . . 72.15 112.273 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.89 104.4 2.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.445 . . . . 71.11 110.888 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.6 p -56.82 111.93 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.108 -0.496 . . . . 71.41 111.143 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.85 -8.83 6.09 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.718 -0.753 . . . . 45.24 112.435 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.7 tp -89.74 111.78 22.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.84 0.352 . . . . 74.54 110.901 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -123.75 163.9 20.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 74.32 110.857 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -159.2 136.99 10.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.213 -0.449 . . . . 73.42 110.918 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 86.3 t -110.23 137.38 42.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.166 -0.47 . . . . 70.32 111.125 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -150.69 145.58 25.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 73.35 110.912 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.5 124.09 11.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 65.33 110.958 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 t -60.46 114.42 2.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.184 -0.462 . . . . 74.4 110.851 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.3 m -68.73 -53.17 23.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 71.34 111.143 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -63.49 -29.38 70.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 73.54 110.862 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -125.97 96.11 38.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.667 0.746 . . . . 74.23 110.947 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.66 127.09 14.17 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.69 2.26 . . . . 73.42 112.314 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.4 -15.72 22.37 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.72 -0.752 . . . . 51.01 112.472 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -117.59 179.23 4.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.89 0.376 . . . . 73.15 110.868 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -124.68 162.81 23.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.118 -0.492 . . . . 75.21 110.924 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 89.8 m -134.72 126.45 29.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.122 -0.49 . . . . 65.51 111.136 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.23 119.83 37.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.915 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.5 t -105.94 122.44 46.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 73.04 110.902 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.7 t -122.67 151.01 26.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.268 -0.423 . . . . 73.25 111.121 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.54 111.0 23.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.868 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.47 94.59 4.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 71.53 110.881 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 66.23 29.88 9.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 72.4 110.905 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.87 -13.17 63.93 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.72 -0.753 . . . . 72.33 112.492 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -88.01 140.06 29.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.836 0.35 . . . . 74.43 110.906 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 8.8 m -101.25 107.88 22.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 71.43 111.111 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -97.05 123.05 40.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 74.32 110.865 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -102.41 125.17 49.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 74.45 110.895 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -113.01 112.56 24.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 73.23 110.924 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.37 132.79 48.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.092 -0.504 . . . . 75.14 110.884 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 29.3 mt -113.19 110.1 30.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.224 -0.444 . . . . 74.44 111.18 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.04 128.56 34.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 75.11 110.904 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -115.42 101.37 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.411 . . . . 75.01 110.888 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -136.49 142.57 43.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.479 . . . . 74.21 110.848 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.14 35.96 25.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 73.01 111.169 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.28 29.6 19.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 73.03 110.825 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -136.23 142.3 44.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.08 -0.509 . . . . 74.51 110.905 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mp -103.86 150.06 24.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.25 -0.432 . . . . 73.13 110.9 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 33.8 t -167.37 140.45 3.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.161 -0.472 . . . . 74.22 110.846 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 58.9 mt -115.7 -28.76 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.143 -0.481 . . . . 65.2 111.125 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -95.28 -1.74 50.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 75.14 110.875 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 61.57 17.03 8.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 64.4 110.862 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -127.49 -33.99 2.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 74.23 110.882 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -112.21 104.58 17.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.112 -0.494 . . . . 63.32 111.09 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -97.79 143.98 27.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 73.52 111.01 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -118.55 178.07 4.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 75.34 110.875 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.55 -15.44 17.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 74.23 110.859 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -165.39 172.27 12.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.175 -0.466 . . . . 71.02 110.93 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.63 -24.78 58.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.168 -0.469 . . . . 75.25 110.909 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.3 tmm? -61.54 -57.09 13.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.271 -0.422 . . . . 73.41 110.903 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.65 -36.1 82.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 75.24 110.94 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.69 -48.27 75.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.439 . . . . 73.05 110.92 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 73.6 t -64.84 -37.43 80.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 72.51 111.19 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -56.1 -38.12 70.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 74.21 110.887 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.09 -44.33 63.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.47 . . . . 75.5 110.879 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -71.1 -16.14 62.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 74.12 110.925 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 95.4 m -87.02 -33.3 19.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.501 . . . . 72.34 111.123 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.4 t -80.52 -24.29 39.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 64.01 111.153 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -157.47 155.01 29.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 71.13 110.845 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.18 -57.46 8.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 73.32 111.102 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 60.01 20.75 9.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 74.14 110.866 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.78 17.24 7.54 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.756 -0.735 . . . . 75.22 112.507 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 9.7 mp -111.18 139.13 46.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.833 0.349 . . . . 72.03 110.935 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 38.4 t -51.37 -31.76 23.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 74.52 110.904 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 5.3 t -156.02 124.42 5.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 34.02 111.174 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -51.43 146.87 6.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 73.13 110.78 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.7 mt -65.74 138.45 57.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.144 -0.48 . . . . 73.34 110.901 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 26.4 mt -127.24 -51.31 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.168 -0.469 . . . . 73.21 111.132 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 1.8 mmtp -129.2 121.98 20.87 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.605 0.717 . . . . 71.4 110.902 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 138.24 37.6 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.718 2.278 . . . . 64.44 112.3 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.46 83.36 0.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 75.24 110.88 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.5 m -64.46 134.91 28.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 75.42 111.148 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.5 ptm . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 73.04 110.853 179.943 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.374 0 CA-C-O 121.494 0.497 . . . . 52.4 112.546 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.66 167.86 23.08 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.7 2.267 . . . . 71.23 112.323 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 10.3 mp -52.94 -42.47 65.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.135 -0.484 . . . . 63.1 110.884 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 87.53 29.37 21.85 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.7 -0.762 . . . . 73.11 112.474 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 7.1 t -88.4 57.03 4.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.904 0.383 . . . . 73.21 110.818 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -131.15 135.75 47.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 74.4 110.902 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 6.0 mtm180 -100.26 105.85 17.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 73.42 110.883 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -171.04 131.94 0.82 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 75.03 110.832 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.46 105.54 6.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 73.24 110.82 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 37.2 p -59.42 -178.95 0.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 73.52 110.886 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -158.05 99.59 1.67 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 71.14 110.944 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.6 t -96.2 88.95 4.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 53.32 110.882 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -71.47 147.09 48.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 64.53 110.869 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.06 129.48 21.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.11 -0.495 . . . . 74.1 110.869 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.86 161.29 14.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 74.44 110.851 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -61.33 -17.74 55.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 74.15 110.875 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -36.99 84.62 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.132 -0.485 . . . . 73.44 110.914 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -100.33 -20.61 15.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 74.34 110.933 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -147.82 79.07 9.52 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.619 0.724 . . . . 65.22 110.825 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -6.54 18.85 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.678 2.252 . . . . 75.54 112.35 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.3 t -94.05 27.47 2.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.23 -0.441 . . . . 62.41 111.129 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 47.6 mt -100.64 136.94 39.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.247 -0.433 . . . . 74.41 110.875 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.2 t -108.96 172.34 6.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 62.54 111.158 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -48.98 -34.16 12.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.2 -0.455 . . . . 71.33 110.93 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -64.28 -45.09 89.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 72.32 110.895 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -74.31 -50.21 19.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.49 . . . . 71.14 110.847 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 40.6 mm -55.69 -53.05 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 71.44 111.131 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 25.0 m -62.74 -32.48 73.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 54.11 110.851 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -62.88 -16.56 59.27 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.146 -0.479 . . . . 75.15 111.145 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -97.88 14.02 28.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 74.15 110.905 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 2.1 t -100.62 -33.19 10.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.117 -1.401 . . . . 74.01 110.864 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 3.1 m 63.88 158.03 0.08 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 74.11 110.876 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 4.7 m -51.61 123.21 2.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.145 -0.479 . . . . 65.33 111.196 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -137.87 77.67 1.64 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 73.2 110.852 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -52.27 156.86 2.6 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.534 0.683 . . . . 75.54 110.957 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.68 112.64 3.12 Favored 'Trans proline' 0 N--CA 1.465 -0.177 0 C-N-CA 122.691 2.261 . . . . 73.21 112.407 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 CA-C-O 119.138 -0.812 . . . . 74.31 112.484 179.993 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 CA-C-O 121.477 0.487 . . . . 70.32 112.512 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -41.69 4.06 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.662 2.242 . . . . 61.13 112.323 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.4 mt -115.39 -30.8 6.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.22 -0.445 . . . . 74.22 110.941 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.57 -69.64 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.772 -0.728 . . . . 74.13 112.519 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.3 t -152.19 60.38 0.84 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 72.13 110.907 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -134.29 73.88 68.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.646 0.736 . . . . 74.13 110.859 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -7.97 22.42 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.689 2.26 . . . . 60.42 112.316 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 38.0 p-90 -102.76 -30.13 11.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 75.43 110.871 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -87.42 97.22 10.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 75.42 110.908 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.77 -37.48 59.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 72.02 110.894 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.7 25.94 56.57 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.704 -0.76 . . . . 65.31 112.474 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.26 67.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.726 0.298 . . . . 74.42 110.91 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 15.5 mm -128.41 144.12 38.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 73.21 111.111 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.87 171.23 8.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.153 -0.476 . . . . 74.33 111.198 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -62.03 -39.08 91.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 74.45 110.829 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -75.15 -32.8 61.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 55.54 110.952 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -69.97 -41.38 74.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.161 -0.472 . . . . 73.22 110.888 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.26 -36.55 63.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 71.34 111.051 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.64 -53.21 60.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 75.32 110.887 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.45 -34.08 76.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 73.32 110.884 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 9.5 mt -54.88 -38.42 67.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 72.04 110.938 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -100.27 43.57 1.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 73.41 110.894 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.503 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.38 -59.47 4.91 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.712 0.768 . . . . 74.43 110.902 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 52.7 Cg_endo -69.78 123.74 10.39 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.74 2.294 . . . . 73.11 112.304 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 115.63 4.19 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.639 2.226 . . . . 73.2 112.3 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -155.34 121.03 5.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.254 -0.43 . . . . 65.53 110.871 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -72.39 111.74 7.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.097 -0.501 . . . . 75.2 111.128 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.28 -4.32 6.76 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.696 -0.764 . . . . 72.02 112.481 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 3.8 tp -90.24 120.92 31.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.908 0.385 . . . . 75.23 110.895 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.7 p90 -133.05 175.94 8.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.118 -0.492 . . . . 73.13 110.919 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -169.47 134.27 1.43 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 74.25 110.863 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 84.7 t -110.93 131.4 62.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 75.02 111.161 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.66 150.81 36.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 74.5 110.863 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -57.5 124.08 17.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 74.53 110.927 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.5 m -57.94 117.1 3.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.868 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.9 m -69.01 -56.17 8.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 74.14 111.071 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -71.97 -26.76 62.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 74.51 110.913 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -108.42 90.63 7.31 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.655 0.74 . . . . 70.24 110.922 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 113.56 3.41 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.71 2.273 . . . . 73.03 112.339 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.44 2.62 24.4 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.704 -0.76 . . . . 73.24 112.512 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -130.78 -172.62 2.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.82 0.343 . . . . 73.02 110.853 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -140.52 145.23 36.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.882 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 31.6 m -108.95 128.22 54.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 64.32 111.12 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.86 104.7 13.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 72.22 110.916 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.3 m -87.21 153.91 21.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.185 -0.461 . . . . 74.54 110.843 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.8 t -146.58 142.66 20.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 71.55 111.192 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.13 111.29 22.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 64.55 110.803 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -123.23 93.55 3.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 75.44 110.905 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 67.5 29.27 7.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 73.13 110.837 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.68 -19.05 56.18 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.741 -0.742 . . . . 74.22 112.464 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -87.44 136.68 32.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.851 0.358 . . . . 73.15 110.891 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.1 p -97.26 106.73 18.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 74.43 111.105 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -91.95 120.19 32.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.123 -0.49 . . . . 64.4 110.924 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -87.79 124.72 33.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 74.31 110.878 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -114.14 106.8 14.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 75.4 110.919 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -64.06 141.28 58.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 73.31 110.905 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 61.9 mt -123.25 111.25 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 75.13 111.13 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.32 125.07 31.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 74.14 110.862 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -111.77 98.27 7.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 75.31 110.947 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -130.83 142.56 50.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 65.43 110.872 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.2 35.96 25.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 74.04 111.182 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.44 29.32 18.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.473 . . . . 73.35 110.861 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mtmm -134.1 139.93 46.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 74.55 110.91 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.8 mp -102.01 149.21 24.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.271 -0.422 . . . . 73.32 110.934 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.2 p -165.69 140.57 4.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 71.3 110.901 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 50.1 mt -115.56 -32.5 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 74.12 111.155 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -89.64 1.14 56.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 75.42 110.918 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 60.53 17.81 7.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 74.55 110.865 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -132.43 -38.59 1.04 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 73.12 110.88 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.48 104.6 16.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 73.14 111.104 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -99.95 144.58 28.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 73.12 110.933 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -117.89 177.77 4.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 75.03 110.896 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.65 -15.31 17.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 74.32 110.919 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -166.06 172.13 11.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 75.5 110.933 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.6 -24.45 58.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.202 -0.454 . . . . 73.14 110.943 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.88 -56.94 14.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 71.11 110.904 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.95 -35.33 80.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 74.45 110.917 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.59 -52.4 63.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.463 . . . . 73.14 110.924 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.77 -36.63 76.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 75.52 111.099 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -55.51 -39.09 70.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 72.22 110.856 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -72.08 -44.18 63.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 74.34 110.857 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -67.91 -21.94 65.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.445 . . . . 63.01 110.929 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 63.0 m -84.57 -30.2 25.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.081 -0.508 . . . . 73.43 111.172 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 93.5 m -79.84 -24.01 41.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.191 -0.459 . . . . 75.42 111.18 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -163.15 159.54 23.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 72.33 110.835 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.25 -57.99 7.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 74.43 111.047 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 57.04 24.18 9.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.212 -0.449 . . . . 73.43 110.891 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 112.75 0.89 25.86 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.707 -0.759 . . . . 75.13 112.471 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -95.71 136.22 36.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.923 0.392 . . . . 65.14 110.922 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 49.3 t -51.82 -28.94 17.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.15 -0.477 . . . . 64.24 110.908 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.2 t -156.97 123.46 4.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.123 -0.489 . . . . 71.12 111.102 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -51.49 139.99 18.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.231 -0.44 . . . . 74.22 110.892 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 8.6 mt -62.32 135.81 57.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 73.42 110.946 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 29.3 mt -127.05 -51.4 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.431 . . . . 75.13 111.18 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -126.88 118.29 22.34 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.574 0.702 . . . . 74.44 110.881 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 138.15 37.15 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.757 2.305 . . . . 75.13 112.373 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 84.9 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 73.51 110.913 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 33.9 m -64.34 138.8 22.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 74.4 111.174 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.1 ptm . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 74.42 110.854 179.892 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 CA-C-O 121.474 0.486 . . . . 52.25 112.456 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.71 165.7 30.04 Favored 'Trans proline' 0 N--CA 1.464 -0.207 0 C-N-CA 122.745 2.296 . . . . 71.22 112.372 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.06 -40.82 64.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.262 -0.427 . . . . 72.54 110.86 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 91.61 23.09 29.43 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.763 -0.732 . . . . 74.23 112.47 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 3.2 m -101.84 127.24 48.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.921 0.391 . . . . 64.02 110.931 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -153.9 173.27 16.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 74.13 110.914 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.79 115.94 20.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.272 -0.422 . . . . 74.32 110.804 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -175.45 126.9 0.25 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.12 -0.491 . . . . 72.43 110.891 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 91.5 p -114.83 89.87 3.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 75.1 110.834 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 89.1 p -60.29 -172.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 63.43 110.799 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -163.84 103.88 0.91 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 75.41 110.919 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 28.4 t -92.47 88.65 6.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 73.34 110.856 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -71.62 147.69 47.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.47 . . . . 70.02 110.934 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.5 mtpp -154.0 129.46 9.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 73.53 110.921 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.61 175.3 5.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 71.43 110.887 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 41.8 mtt180 -63.7 -16.0 59.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 75.41 110.913 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.04 -42.12 98.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 74.03 110.903 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -103.12 -15.55 16.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 74.32 110.925 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -151.37 78.16 7.13 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.551 0.691 . . . . 75.11 110.801 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 -6.28 18.25 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.606 2.204 . . . . 74.54 112.326 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.7 t -93.4 27.23 2.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 74.32 111.096 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 36.8 mt -103.48 137.81 41.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.217 -0.447 . . . . 74.22 110.888 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.5 t -103.48 173.52 6.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 72.42 111.118 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.87 -35.23 22.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 74.31 110.838 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -63.28 -48.32 78.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.187 -0.461 . . . . 72.33 110.927 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -66.43 -52.27 48.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 74.11 110.897 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 45.8 mm -56.82 -45.75 83.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 63.42 111.12 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 32.6 p -72.5 -15.94 61.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 71.43 110.904 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -81.98 1.75 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.119 -0.491 . . . . 74.34 111.115 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 2.3 mtt -115.25 14.51 16.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 75.33 110.833 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 27.3 t -115.35 -35.13 4.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.171 -1.377 . . . . 73.44 110.935 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 6.0 t 65.06 150.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.089 -0.505 . . . . 75.31 110.9 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 4.3 m -51.64 123.07 2.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.094 -0.503 . . . . 74.45 111.121 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -134.49 75.0 1.56 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.485 . . . . 75.12 110.875 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.1 mtmp? -55.57 160.55 3.8 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.571 0.7 . . . . 73.13 110.857 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 111.03 2.71 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.67 2.247 . . . . 74.12 112.271 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.361 0 CA-C-O 119.126 -0.819 . . . . 62.43 112.509 179.939 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.308 0 CA-C-O 121.424 0.458 . . . . 75.35 112.515 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 -42.15 3.73 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.673 2.249 . . . . 72.33 112.374 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.87 28.26 3.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 72.42 110.958 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.09 -105.89 0.35 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.678 -0.772 . . . . 75.33 112.454 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 67.6 m -148.93 63.52 1.05 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.882 0.372 . . . . 71.04 110.852 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -138.14 68.32 48.35 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.606 0.717 . . . . 73.22 110.797 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -32.92 17.7 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.717 2.278 . . . . 73.01 112.412 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 49.5 p-90 -54.89 -25.68 30.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 71.32 110.921 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -90.36 99.22 12.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 73.31 110.881 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -75.89 -40.69 53.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.119 -0.491 . . . . 72.35 110.778 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.83 24.84 54.91 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.732 -0.747 . . . . 73.43 112.512 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.79 65.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.815 0.34 . . . . 74.43 110.93 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.3 mm -129.73 144.21 38.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.145 -0.48 . . . . 72.43 111.081 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.77 177.17 5.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 75.1 111.175 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.3 ppt_? -64.59 -40.84 96.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.88 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -71.53 -34.74 70.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 74.42 110.869 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -73.29 -42.27 62.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 71.54 110.882 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.17 -33.81 63.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 74.4 111.098 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -62.2 -53.25 57.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 75.31 110.857 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -35.01 79.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.843 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 12.9 mt -59.09 -36.19 74.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.917 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -104.43 43.48 1.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 64.22 110.9 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.482 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.56 -59.98 5.22 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.675 0.75 . . . . 72.44 110.94 -179.999 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.482 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.5 Cg_endo -69.86 123.51 10.14 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.641 2.227 . . . . 74.53 112.311 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 117.35 5.03 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.608 2.206 . . . . 64.51 112.379 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -154.84 115.2 3.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 71.44 110.863 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.53 111.91 3.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 74.32 111.2 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.5 -6.47 6.26 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.695 -0.764 . . . . 72.31 112.452 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.6 tp -90.47 111.75 23.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.83 0.347 . . . . 72.55 110.936 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 22.3 p90 -124.43 163.66 21.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.462 . . . . 74.44 110.866 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -159.49 137.11 9.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.478 . . . . 74.31 110.902 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.2 t -110.22 137.89 40.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 75.13 111.157 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.71 145.76 26.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.148 -0.478 . . . . 73.13 110.938 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -51.9 124.22 12.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 72.32 110.881 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.7 m -58.31 110.96 1.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 71.42 110.81 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.8 m -68.82 -54.67 14.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 72.35 111.161 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -63.72 -27.92 69.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 72.31 110.859 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -123.14 95.28 46.05 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.659 0.742 . . . . 74.24 110.898 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 122.64 9.33 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.672 2.248 . . . . 73.33 112.364 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.49 -2.32 24.94 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.745 -0.741 . . . . 64.44 112.476 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -131.09 -175.94 3.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.856 0.36 . . . . 73.54 110.822 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -131.54 164.57 25.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.915 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.8 m -135.93 139.48 43.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 62.04 111.134 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.98 117.18 33.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.199 -0.455 . . . . 75.2 110.95 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.3 m -101.52 123.93 46.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.12 110.896 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.3 t -123.12 151.72 27.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 75.03 111.136 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -101.09 111.59 23.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 73.43 110.882 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.43 91.04 3.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.13 -0.486 . . . . 72.15 110.943 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 67.12 30.72 7.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 74.35 110.826 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.95 -14.83 62.4 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.822 -0.704 . . . . 72.31 112.505 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.3 ptpt -88.11 140.18 29.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.813 0.34 . . . . 72.11 110.885 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 8.6 m -99.94 108.9 23.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.253 -0.431 . . . . 74.33 111.085 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -95.9 121.8 38.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 71.55 110.929 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -99.73 124.67 45.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 72.54 110.892 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -111.13 117.23 32.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 74.54 110.92 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -67.64 132.29 47.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 71.35 110.871 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 55.1 mt -113.56 107.57 23.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 75.3 111.116 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.9 ttm -83.92 122.56 28.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.19 -0.459 . . . . 72.53 110.902 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -111.29 99.4 8.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 75.1 110.913 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -133.44 142.54 48.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 75.33 110.927 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 57.21 35.96 26.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.298 -0.41 . . . . 75.54 111.126 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.7 t 60.85 28.12 17.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 74.3 110.91 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.12 140.67 45.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 75.23 110.902 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.0 mp -102.2 147.65 26.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 72.52 110.911 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.95 137.66 5.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 54.23 110.828 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 51.0 mt -113.35 -31.93 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 74.35 111.152 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -90.52 1.2 56.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 75.23 110.894 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 60.62 17.81 7.81 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 60.5 110.899 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -132.43 -38.7 1.04 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 65.42 110.912 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.27 104.64 16.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 63.24 111.141 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -100.0 143.26 30.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 73.34 110.86 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -117.83 175.14 5.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 73.1 110.87 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.63 -1.91 34.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.505 . . . . 71.23 110.88 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -179.31 172.23 1.22 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 71.43 110.884 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.24 -28.18 59.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 70.42 110.925 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.0 ttt -58.03 -57.21 13.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 75.23 110.843 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -65.69 -37.31 86.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 73.44 110.944 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.43 -46.91 76.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 63.32 110.949 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 69.3 t -64.6 -39.47 85.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 75.44 111.152 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -54.83 -38.72 67.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.103 -0.498 . . . . 73.3 110.949 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.31 -45.43 63.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 74.13 110.887 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -67.22 -21.98 65.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 75.45 110.935 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 58.7 m -84.15 -29.95 26.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 73.33 111.139 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 86.4 m -78.13 -27.0 48.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.203 -0.453 . . . . 73.54 111.121 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -164.71 155.65 14.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.245 -0.434 . . . . 75.51 110.838 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.35 -58.2 6.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.135 -0.484 . . . . 75.11 111.092 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 52.51 28.97 6.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 72.25 110.873 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 121.89 -2.54 10.88 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.712 -0.756 . . . . 74.42 112.514 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 9.6 mp -101.62 136.45 41.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.786 0.327 . . . . 72.12 110.969 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 19.5 p -54.42 -26.72 32.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.169 -0.469 . . . . 73.14 110.894 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 9.0 t -157.31 125.09 5.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.103 -0.499 . . . . 70.1 111.126 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -51.96 164.99 0.23 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 75.34 110.845 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 11.5 mt -84.58 138.72 32.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 71.4 110.924 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 27.7 mt -127.22 -51.22 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 75.03 111.106 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -128.58 121.22 21.11 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.533 0.682 . . . . 74.24 110.935 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.84 136.99 34.19 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.633 2.222 . . . . 74.42 112.31 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.41 83.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 74.3 110.88 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 26.9 m -64.64 133.1 30.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 71.33 111.136 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 37.6 mtm . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 72.03 110.822 179.929 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.236 0 CA-C-O 121.423 0.457 . . . . 65.32 112.464 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 169.48 18.83 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 122.704 2.27 . . . . 73.04 112.321 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 47.1 mt -56.5 -39.45 73.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.215 -0.448 . . . . 75.04 110.903 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 102.64 -29.19 13.0 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.797 -0.716 . . . . 73.41 112.487 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 5.3 m -84.37 137.14 33.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.964 0.411 . . . . 74.32 110.859 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 3.6 mttp -141.06 178.91 7.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 73.54 110.911 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.57 93.7 3.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 75.32 110.854 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -171.81 101.69 0.18 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 72.12 110.864 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 1.7 t -128.25 137.42 51.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.486 . . . . 72.41 110.868 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 93.2 p -64.32 -172.02 0.06 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 74.12 110.91 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -162.95 106.4 1.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 75.53 110.876 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.25 88.83 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 70.32 110.837 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -72.61 146.9 46.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 75.25 110.904 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -140.82 129.23 22.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.081 -0.509 . . . . 74.35 110.822 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.31 156.21 17.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 75.45 110.856 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -59.17 -19.37 44.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.092 -0.504 . . . . 72.11 110.843 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.7 -39.5 88.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 74.42 110.867 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -96.2 -20.16 18.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.46 . . . . 71.43 111.017 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -147.34 77.77 10.51 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.596 0.712 . . . . 75.13 110.888 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -6.37 18.41 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.716 2.277 . . . . 71.24 112.349 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.2 t -93.79 27.45 2.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.249 -0.432 . . . . 65.04 111.167 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 42.1 mt -100.56 136.79 39.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 75.34 110.979 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.5 t -106.45 173.76 6.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 62.34 111.083 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -49.92 -37.45 31.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 74.41 110.89 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -60.87 -50.68 72.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 75.11 110.877 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -66.21 -52.04 51.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 71.34 110.907 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 44.7 mm -56.04 -53.5 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 73.44 111.092 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 20.1 m -64.18 -19.05 65.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 73.44 110.832 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.28 3.79 26.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.101 -0.5 . . . . 75.01 111.134 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -114.37 14.03 17.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 73.24 110.818 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 23.1 t -98.2 -31.63 11.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.111 -1.404 . . . . 73.12 110.88 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.34 155.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 70.42 110.866 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 4.3 m -51.74 120.54 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 75.44 111.145 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -135.43 74.66 1.52 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 75.4 110.955 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? -58.31 160.43 9.45 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.596 0.712 . . . . 64.33 110.922 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 113.51 3.39 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.675 2.25 . . . . 74.4 112.374 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 CA-C-O 119.15 -0.806 . . . . 74.42 112.565 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 CA-C-O 121.44 0.467 . . . . 74.43 112.451 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -46.11 1.35 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.68 2.253 . . . . 72.2 112.385 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -135.69 29.1 3.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.45 . . . . 74.23 110.937 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 154.88 -128.96 2.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.733 -0.746 . . . . 71.33 112.515 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 66.6 m -137.42 55.0 1.82 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.884 0.374 . . . . 73.14 110.878 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.35 74.42 80.98 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.57 0.7 . . . . 73.23 110.869 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.68 -25.77 28.61 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.719 2.279 . . . . 63.35 112.285 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 46.9 p-90 -54.44 -27.1 34.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.261 -0.427 . . . . 70.4 110.915 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -86.52 100.83 12.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 73.32 110.924 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -75.81 -39.42 56.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 74.33 110.894 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.28 22.7 45.06 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.787 -0.72 . . . . 53.22 112.495 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 pttt 179.01 68.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.717 0.294 . . . . 73.12 110.872 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 mm -133.7 144.21 36.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 74.21 111.138 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.23 177.03 5.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.472 . . . . 75.44 111.176 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -43.57 96.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 74.01 110.84 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.44 -32.52 72.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 74.14 110.897 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -75.61 -43.16 49.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.128 -0.487 . . . . 72.54 110.934 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.83 -33.57 64.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 64.21 111.129 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -63.34 -53.29 54.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 65.3 110.883 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.08 -34.92 79.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 73.44 110.849 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 13.5 mt -60.56 -35.78 76.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 74.41 110.974 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -102.32 43.55 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 71.32 110.861 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.481 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.24 -60.04 5.48 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.673 0.749 . . . . 73.13 110.917 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.82 123.17 9.82 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.727 2.284 . . . . 74.5 112.345 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 117.82 5.31 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.63 2.22 . . . . 74.25 112.396 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -154.81 104.79 2.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 71.41 110.916 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.2 p -57.98 111.92 1.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 74.13 111.165 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.05 -7.2 6.07 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.772 -0.728 . . . . 74.11 112.522 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.02 113.61 25.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.886 0.375 . . . . 75.41 110.899 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 27.0 p90 -125.22 165.2 18.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 75.1 110.853 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -161.54 137.28 7.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 74.31 110.939 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 89.0 t -110.19 142.88 21.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 74.12 111.132 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.96 148.83 25.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 74.4 110.855 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -52.08 124.21 12.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 73.35 110.916 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.2 m -59.81 117.31 4.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 72.33 110.928 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.3 m -69.12 -56.42 7.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.482 . . . . 61.04 111.146 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.96 -24.0 62.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 75.01 110.899 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -113.28 93.51 26.72 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.727 0.775 . . . . 74.32 110.94 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 111.07 2.7 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.721 2.28 . . . . 75.23 112.38 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.6 0.14 24.7 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.768 -0.73 . . . . 50.34 112.53 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -125.29 -175.88 3.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.797 0.332 . . . . 73.22 110.867 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -137.38 148.0 45.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 73.21 110.916 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 25.4 m -115.51 141.68 47.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.108 -0.496 . . . . 73.41 111.156 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -111.79 116.56 30.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 73.2 110.911 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.1 t -100.65 129.16 46.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 75.21 110.911 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.3 t -130.03 149.11 33.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 73.31 111.066 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.07 111.03 23.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 61.03 110.852 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.47 93.5 4.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 74.22 110.901 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 66.14 30.78 9.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.839 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.6 -14.3 63.29 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.73 -0.748 . . . . 74.22 112.536 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -88.08 147.5 24.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.756 0.312 . . . . 75.14 110.926 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 7.0 m -105.51 109.22 27.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 64.12 111.14 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -96.94 113.7 25.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 72.33 110.865 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -91.13 124.65 35.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 74.24 110.815 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -114.08 116.19 28.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.218 -0.446 . . . . 73.23 110.909 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.48 137.07 46.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.102 -0.499 . . . . 71.23 110.872 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 26.0 mt -119.7 109.62 26.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 74.5 111.113 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -81.3 124.72 29.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.272 -0.422 . . . . 74.11 110.902 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -111.67 98.29 7.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.307 -0.406 . . . . 75.22 110.937 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -132.06 142.57 49.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 72.4 110.897 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.18 35.97 26.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 74.44 111.073 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.38 26.6 16.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 71.4 110.84 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -131.93 139.14 48.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 74.35 110.894 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mp -102.42 149.86 23.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 73.3 110.922 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 29.2 t -166.19 140.96 4.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 61.12 110.814 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 52.2 mt -115.59 -32.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.048 -0.524 . . . . 74.24 111.173 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -89.7 1.05 56.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 72.12 110.92 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 60.41 18.18 7.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 71.0 110.795 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -132.29 -38.43 1.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 72.3 110.88 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.4 t -103.06 104.54 16.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 73.14 111.132 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -99.88 144.69 28.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 62.01 110.933 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -118.64 178.42 4.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 74.14 110.924 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -100.19 -16.22 17.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 75.23 110.917 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -164.81 171.65 13.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.111 -0.495 . . . . 73.11 110.874 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.63 -22.37 58.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 71.54 110.949 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.2 ttp -63.67 -56.96 11.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 74.22 110.876 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.82 -36.3 83.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.289 -0.414 . . . . 75.45 110.885 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.68 -47.58 76.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.198 -0.455 . . . . 73.53 110.916 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 70.7 t -65.29 -37.49 80.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 73.13 111.14 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -55.53 -38.76 69.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.134 -0.485 . . . . 74.34 110.926 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -45.29 61.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.891 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -67.5 -22.17 65.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 74.14 110.962 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 63.6 m -84.32 -29.62 26.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.105 -0.498 . . . . 74.03 111.088 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 92.6 m -78.13 -26.94 48.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 75.21 111.15 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.09 160.8 30.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 72.1 110.85 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.81 -58.28 6.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 71.33 111.068 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 6.0 t0 57.12 23.58 8.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 73.13 110.947 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.29 -0.64 25.2 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.721 -0.752 . . . . 32.42 112.498 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -93.28 140.08 29.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.942 0.401 . . . . 73.53 110.855 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 44.3 t -51.33 -30.37 18.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 72.21 110.871 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.8 t -158.96 127.34 5.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 70.33 111.137 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -51.35 140.59 16.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 71.4 110.868 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 8.6 mt -62.39 139.51 58.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 71.52 110.919 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 26.6 mt -126.94 -51.3 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.284 -0.416 . . . . 75.33 111.164 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -131.03 123.35 19.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.585 0.707 . . . . 75.31 110.951 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 135.43 30.44 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.711 2.274 . . . . 75.44 112.331 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.8 83.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.434 . . . . 75.22 110.886 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.7 m -64.32 136.8 25.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.296 -0.411 . . . . 72.12 111.165 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 72.25 110.824 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 CA-C-O 121.432 0.462 . . . . 72.03 112.451 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 168.41 21.56 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.666 2.244 . . . . 72.22 112.365 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 4.6 tp -52.27 -43.26 64.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 73.03 110.917 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 111.21 -40.01 2.7 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.674 -0.775 . . . . 75.21 112.469 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 2.1 t -70.53 96.36 1.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.907 0.384 . . . . 71.12 110.87 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 5.2 mttm -143.09 155.25 44.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 75.31 110.878 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.9 92.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 71.24 110.851 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 5.2 t80 179.18 108.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 75.42 110.934 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 31.5 t -79.94 109.88 14.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 74.24 110.816 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 80.0 p -77.9 -178.22 5.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.474 . . . . 75.34 110.821 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 1.7 mt -160.81 98.46 1.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.089 -0.505 . . . . 72.43 110.868 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 40.0 t -84.83 88.68 7.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 73.23 110.832 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -76.08 149.61 37.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 74.35 110.972 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.57 129.17 17.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.117 -0.492 . . . . 65.43 110.932 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.13 163.05 13.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.286 -0.416 . . . . 63.22 110.862 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 10.6 mtt180 -63.8 -15.42 58.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 72.31 110.853 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -37.94 84.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 74.22 110.876 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -96.98 -14.96 21.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.107 -0.497 . . . . 65.33 110.794 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -156.39 80.75 3.7 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.577 0.703 . . . . 75.35 110.85 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -6.01 17.6 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.693 2.262 . . . . 65.04 112.341 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.2 t -93.61 27.26 2.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 72.23 111.188 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 34.7 mt -103.9 136.89 42.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 72.24 110.875 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 10.1 t -102.16 170.05 8.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.164 -0.471 . . . . 72.42 111.139 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -49.67 -33.89 16.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 65.11 110.919 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -62.5 -48.44 79.54 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.162 -0.472 . . . . 72.41 110.9 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -65.14 -51.72 59.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 73.41 110.92 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 27.4 mm -58.59 -53.77 42.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 75.15 111.089 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 26.8 t -58.01 -24.3 57.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 75.24 110.84 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -74.55 -5.67 44.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 62.14 111.069 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.68 14.02 19.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.256 -0.429 . . . . 74.15 110.879 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 3.9 t -102.96 -36.13 8.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.115 -1.402 . . . . 70.33 110.795 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.88 152.82 0.05 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 72.23 110.915 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 4.5 m -54.19 122.28 3.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.468 . . . . 73.41 111.096 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -132.95 74.88 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.069 -0.514 . . . . 74.1 110.919 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.93 160.32 2.29 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.603 0.716 . . . . 63.1 110.932 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 112.28 3.03 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.674 2.249 . . . . 62.42 112.31 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.26 0 CA-C-O 119.169 -0.795 . . . . 63.03 112.471 179.959 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 CA-C-O 121.429 0.461 . . . . 75.01 112.554 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -46.87 1.06 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.653 2.235 . . . . 75.11 112.334 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.11 -43.56 14.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 72.43 110.908 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.61 24.46 5.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.702 -0.761 . . . . 53.3 112.479 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -157.49 27.65 0.29 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.886 0.374 . . . . 53.34 110.862 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -168.65 72.68 0.8 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.593 0.711 . . . . 73.41 110.942 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -27.78 26.18 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.675 2.25 . . . . 71.32 112.293 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 47.0 p-90 -54.82 -26.63 36.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 75.24 110.925 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -84.31 102.33 12.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 74.21 110.876 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 -76.39 -40.05 51.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 73.34 110.897 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.3 18.89 37.6 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.744 -0.741 . . . . 73.43 112.472 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -179.96 78.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.737 0.303 . . . . 74.31 110.864 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.5 mm -142.72 144.41 24.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 75.43 111.061 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.32 175.08 5.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.113 -0.494 . . . . 74.32 111.177 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.6 ttt180 -62.19 -42.71 99.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 75.15 110.883 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -68.34 -33.87 75.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.162 -0.472 . . . . 72.24 110.939 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -75.49 -41.78 54.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 74.32 110.922 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.48 -33.48 62.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.482 . . . . 71.11 111.129 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -63.4 -53.27 54.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.45 . . . . 75.33 110.922 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.18 -35.6 81.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.479 . . . . 75.24 110.832 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 16.7 mt -61.21 -35.82 78.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 71.31 110.892 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -102.96 43.12 1.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.19 -0.459 . . . . 75.31 110.878 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.479 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.18 -59.97 4.63 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.678 0.751 . . . . 72.04 110.907 179.996 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.9 Cg_endo -69.74 123.09 9.77 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.719 2.279 . . . . 74.53 112.323 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 118.21 5.54 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.665 2.243 . . . . 72.43 112.334 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -154.81 100.48 2.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.27 -0.423 . . . . 71.23 110.858 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -53.46 111.76 0.77 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 74.25 111.146 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.81 -6.28 6.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.79 -0.719 . . . . 73.15 112.504 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.28 111.75 23.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.808 0.337 . . . . 73.12 110.916 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -124.54 162.06 24.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 73.31 110.89 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -158.37 138.67 12.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 73.4 110.873 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 79.9 t -110.16 137.73 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 75.3 111.145 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -149.8 143.39 25.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.212 -0.449 . . . . 75.54 110.882 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -50.24 123.78 9.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.447 . . . . 75.53 110.823 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 m -57.56 115.79 2.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.456 . . . . 75.35 110.86 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.2 m -68.57 -56.39 8.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 70.02 111.133 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -69.28 -26.62 64.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 71.43 110.921 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -112.28 94.46 26.62 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.632 0.729 . . . . 71.11 110.939 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 112.26 3.03 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.663 2.242 . . . . 73.31 112.384 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.77 3.29 23.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.743 -0.741 . . . . 74.33 112.434 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -131.05 -176.06 3.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.816 0.341 . . . . 72.11 110.907 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -131.67 165.58 23.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 74.31 110.929 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 99.1 m -126.56 141.61 51.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.086 -0.506 . . . . 73.43 111.184 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.16 106.32 16.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.279 -0.418 . . . . 75.33 110.885 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.6 m -98.99 118.69 36.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.47 . . . . 74.12 110.911 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.4 t -124.36 150.41 29.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 72.23 111.045 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.95 112.36 25.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 71.45 110.941 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.6 97.58 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.07 -0.514 . . . . 72.33 110.849 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 65.74 27.61 11.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.884 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.75 -13.38 63.92 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.752 -0.737 . . . . 72.23 112.498 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -88.38 140.3 29.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.764 0.316 . . . . 70.45 110.936 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 11.2 m -100.47 111.37 29.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 72.44 111.13 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -99.68 124.84 45.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.89 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 61.1 m-70 -103.39 124.0 47.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 74.33 110.873 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -114.67 100.24 8.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 74.21 110.964 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -55.54 131.76 46.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 74.34 110.834 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 38.2 mt -110.45 109.63 29.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 72.42 111.133 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.76 129.08 34.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.35 110.924 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -114.97 100.71 8.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.271 -0.422 . . . . 72.11 110.974 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -134.68 142.43 46.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 74.43 110.913 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 57.38 36.13 26.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 63.41 111.058 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.7 t 61.04 27.46 17.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 74.14 110.858 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 2.7 mtmm -133.21 145.34 50.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.136 -0.484 . . . . 75.41 110.82 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.6 mp -106.22 150.8 25.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 72.42 110.909 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.9 t -169.62 140.8 2.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 74.12 110.862 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 59.7 mt -115.51 -26.19 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 61.45 111.175 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 5.9 p30 -96.67 -2.48 44.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 60.14 110.884 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 61.94 16.75 8.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 63.02 110.882 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -127.36 -34.07 2.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 72.33 110.894 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.4 t -111.86 104.75 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 75.51 111.127 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -98.33 143.44 28.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.47 . . . . 75.33 110.931 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -117.51 171.53 7.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.083 -0.508 . . . . 74.11 110.862 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.68 -18.95 24.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.193 -0.458 . . . . 75.53 110.861 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -171.24 158.84 5.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 75.2 110.905 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 2.4 mp -51.36 -36.88 45.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 74.23 110.961 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.4 ttp -51.87 -48.87 63.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 74.5 110.939 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -68.99 -41.67 77.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 71.45 110.943 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.0 -50.55 70.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 62.41 110.906 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 91.4 t -59.02 -43.67 89.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 74.24 111.141 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.78 -39.51 71.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 72.32 110.896 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.75 -50.74 48.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 72.31 110.842 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -65.46 -19.63 66.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.469 . . . . 74.2 110.934 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 97.3 m -84.24 -28.77 27.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.13 -0.486 . . . . 74.31 111.041 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 27.2 m -81.92 -24.4 35.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.331 -0.395 . . . . 71.33 111.148 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -161.7 162.25 29.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 64.15 110.874 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.46 -58.1 7.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.207 -0.451 . . . . 74.24 111.0 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.76 20.5 10.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 75.42 110.911 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 112.3 13.53 11.83 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 75.4 112.483 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.6 mp -108.75 138.41 45.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.85 0.357 . . . . 75.23 110.936 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 31.6 t -51.66 -31.17 24.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.901 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 7.2 t -153.99 124.17 6.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.141 -0.481 . . . . 62.01 111.15 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -51.88 156.08 1.59 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 75.1 110.845 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.7 mt -72.51 134.93 45.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 74.13 110.947 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 24.6 mt -127.03 -51.11 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.191 -0.459 . . . . 75.32 111.179 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -127.55 121.13 22.18 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.534 0.683 . . . . 74.1 110.866 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 135.13 29.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.694 2.263 . . . . 74.11 112.349 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.66 84.04 0.44 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 73.51 110.914 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 22.0 t -64.42 131.42 30.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 72.31 111.099 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 33.3 mtp . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 75.43 110.881 179.91 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 CA-C-O 121.411 0.451 . . . . 71.44 112.493 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 168.12 22.49 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.631 2.221 . . . . 74.44 112.331 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 11.5 tp -63.86 -27.9 69.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.254 -0.43 . . . . 72.54 110.953 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 99.7 27.41 7.99 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.702 -0.761 . . . . 62.3 112.522 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 80.5 p -102.97 164.36 11.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.91 0.386 . . . . 52.32 110.873 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.67 109.74 3.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.15 -0.477 . . . . 74.42 110.933 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -156.15 149.75 24.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.5 110.901 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -169.62 83.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 74.33 110.958 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 1.1 m -176.59 99.88 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 65.24 110.85 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 1.5 m -139.54 90.3 2.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.086 -0.506 . . . . 70.15 110.859 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -163.81 104.63 0.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.888 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 2.2 m -113.59 89.03 2.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 71.4 110.866 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -72.32 148.26 45.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.51 . . . . 75.23 110.896 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -143.12 129.08 19.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.089 -0.505 . . . . 74.53 110.879 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.04 158.77 16.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.232 -0.44 . . . . 72.14 110.781 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -59.76 -19.01 47.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 73.43 110.817 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -37.2 86.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 71.4 110.887 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -96.59 -17.6 20.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 74.44 110.872 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -155.05 79.92 4.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.583 0.706 . . . . 71.22 110.843 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -5.69 16.79 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.654 2.236 . . . . 62.1 112.353 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.4 t -92.68 27.53 2.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 73.42 111.132 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 23.8 mt -102.01 136.79 41.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.424 . . . . 72.33 110.922 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 12.1 t -105.98 174.84 5.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 74.4 111.151 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -49.6 -37.97 29.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 73.41 110.868 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.61 -51.83 66.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.149 -0.478 . . . . 74.23 110.846 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -63.43 -52.08 63.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 74.05 110.909 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 43.1 mm -56.83 -53.78 37.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 75.41 111.1 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 26.3 t -58.85 -22.44 58.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.441 . . . . 74.43 110.868 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.53 4.13 25.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 74.34 111.065 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -109.51 14.3 23.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.863 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 1.6 t -98.71 -27.6 13.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 114.071 -1.422 . . . . 72.45 110.903 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 64.74 153.66 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.049 -0.523 . . . . 71.25 110.822 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 4.6 m -52.56 126.34 8.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.097 -0.501 . . . . 74.35 111.135 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -136.61 77.47 1.65 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 75.42 110.939 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -52.8 160.58 1.4 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.511 0.672 . . . . 75.01 110.95 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 113.52 3.4 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.678 2.252 . . . . 74.44 112.307 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 CA-C-O 119.146 -0.808 . . . . 71.43 112.556 179.948 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 CA-C-O 121.322 0.401 . . . . 74.52 112.468 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 -171.79 0.51 Allowed 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.603 2.202 . . . . 73.42 112.381 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.6 mp -54.64 -30.25 54.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 74.41 110.894 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 106.17 20.45 9.21 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.738 -0.744 . . . . 63.12 112.445 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 32.2 t -170.28 58.42 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.866 0.365 . . . . 72.52 110.905 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.0 mtt -139.96 74.07 32.11 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.498 0.666 . . . . 65.21 110.843 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 -7.55 21.34 Favored 'Trans proline' 0 N--CA 1.466 -0.113 0 C-N-CA 122.665 2.243 . . . . 73.13 112.402 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 35.1 p-90 -101.25 -29.41 12.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 74.35 110.897 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -90.3 106.58 18.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.278 -0.419 . . . . 75.15 110.939 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -83.63 -41.81 17.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 75.44 110.839 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 52.14 34.48 39.77 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.703 -0.761 . . . . 72.52 112.477 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.17 34.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.776 0.322 . . . . 74.23 110.864 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.7 mm -102.69 144.2 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 74.22 111.153 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.06 157.43 17.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 75.1 111.108 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.3 ppt_? -52.94 -36.95 60.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 74.41 110.896 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.2 -32.08 55.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 75.22 110.886 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -72.88 -35.23 67.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 74.13 110.929 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.99 -34.78 59.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 70.24 111.092 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -63.3 -52.69 60.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 72.24 110.863 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -39.51 94.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 71.43 110.811 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.3 mt -54.99 -39.34 68.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.276 -0.42 . . . . 73.41 110.943 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -99.01 43.38 1.06 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.904 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.481 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.42 -59.92 5.43 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.711 0.767 . . . . 74.44 110.926 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.69 123.41 10.1 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.719 2.279 . . . . 75.11 112.418 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 117.53 5.13 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.659 2.239 . . . . 75.54 112.379 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -154.75 112.34 3.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.455 . . . . 70.43 110.965 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.92 111.73 2.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.466 . . . . 70.12 111.209 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.95 -6.2 6.1 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.713 -0.756 . . . . 42.44 112.463 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.94 113.99 26.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.824 0.345 . . . . 72.1 110.922 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 18.9 p90 -125.55 166.09 17.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.141 -0.481 . . . . 72.01 110.863 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -163.93 138.33 5.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.151 -0.477 . . . . 72.33 110.907 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 90.5 t -110.37 128.22 66.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 75.55 111.141 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 145.13 42.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 75.33 110.821 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.62 127.15 19.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 63.3 110.864 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.8 m -61.82 113.34 2.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 73.15 110.87 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.8 m -69.31 -55.99 8.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.487 . . . . 73.02 111.083 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -63.57 -28.97 70.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 75.22 110.888 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.403 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 33.8 m-85 -119.76 96.94 49.76 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.757 0.789 . . . . 74.04 110.94 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.7 Cg_endo -69.77 119.15 6.15 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.672 2.248 . . . . 71.42 112.375 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.73 -12.82 22.76 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.727 . . . . 73.4 112.499 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -114.26 -178.55 3.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.807 0.337 . . . . 75.03 110.85 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -131.05 160.21 35.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 71.05 110.964 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 58.8 m -133.36 131.85 40.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 73.55 111.12 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -100.98 121.39 41.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 72.41 110.836 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.3 m -105.36 126.18 51.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.109 -0.496 . . . . 72.0 110.918 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.1 t -126.0 151.89 32.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.174 -0.466 . . . . 74.43 111.079 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.47 111.72 24.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 73.34 110.874 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.7 93.27 4.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.143 -0.481 . . . . 63.25 110.839 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 66.19 29.72 9.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 71.32 110.962 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.99 -13.42 63.54 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.715 -0.755 . . . . 63.11 112.525 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.2 ptpt -88.3 139.25 30.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.33 . . . . 72.42 110.884 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.0 t -99.66 104.69 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 71.04 111.169 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -92.81 122.06 34.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 73.25 110.918 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -100.84 124.85 47.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.13 -0.486 . . . . 72.41 110.85 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -111.9 118.69 36.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.22 -0.445 . . . . 71.02 110.937 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -68.16 134.99 51.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 75.52 110.87 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 53.2 mt -117.59 109.59 28.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.476 . . . . 74.02 111.15 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.8 129.18 34.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 73.12 110.894 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -114.64 98.99 7.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 72.21 110.89 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -130.94 142.44 50.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 73.51 110.908 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.12 36.77 27.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 73.13 111.07 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.26 23.95 14.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 73.2 110.817 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 3.8 mtmt -128.93 140.48 51.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.164 -0.471 . . . . 72.53 110.947 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 mp -101.73 151.93 21.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 72.54 110.945 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 39.6 t -168.43 142.22 3.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.874 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 52.6 mt -115.54 -40.83 3.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 72.32 111.125 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 38.1 p-10 -88.0 -1.04 57.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 70.1 110.93 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 59.6 20.04 8.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 71.1 110.877 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -123.23 -35.61 2.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 65.12 110.779 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.6 p -119.11 105.02 16.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 71.44 111.056 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -92.92 153.93 18.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 75.45 110.896 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -124.3 174.23 7.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 73.23 110.936 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.76 -17.91 21.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.01 110.849 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -171.82 158.85 5.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.478 . . . . 63.23 110.899 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.86 -36.02 46.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 72.12 110.9 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 2.6 ttt -53.03 -49.55 66.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 73.34 110.946 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -67.84 -39.69 83.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 71.43 110.948 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.9 -51.63 66.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 73.3 110.928 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 98.8 t -59.72 -42.85 90.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.23 111.078 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -54.39 -37.77 65.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 72.12 110.831 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -50.42 28.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 70.12 110.813 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -66.49 -14.6 62.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 75.32 110.895 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 81.7 m -88.73 -32.35 17.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 74.4 111.119 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.9 m -80.27 -22.55 41.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 62.13 111.19 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -161.89 161.96 29.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 73.43 110.892 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.94 -58.07 6.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 75.53 111.124 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.87 18.45 10.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.468 . . . . 74.21 110.836 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.57 3.59 27.05 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.701 -0.761 . . . . 65.2 112.484 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 7.2 mp -95.61 138.63 33.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.85 0.357 . . . . 75.21 110.986 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 41.0 t -51.52 -29.87 18.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 73.53 110.948 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.7 t -156.17 122.76 5.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 74.4 111.101 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -51.28 147.36 5.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 70.13 110.898 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 6.8 mt -65.78 133.86 51.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 73.52 110.987 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 28.1 mt -127.12 -51.32 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 74.32 111.153 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -126.67 118.38 22.71 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.481 0.657 . . . . 75.23 110.961 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.68 139.95 41.79 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.689 2.26 . . . . 73.31 112.36 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.07 82.94 0.51 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 74.31 110.912 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 15.8 m -64.81 125.99 22.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.278 -0.419 . . . . 75.44 111.171 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 30.3 mtp . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 72.54 110.847 179.969 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 CA-C-O 121.45 0.472 . . . . 71.32 112.475 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 164.47 34.44 Favored 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.729 2.286 . . . . 73.44 112.304 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 7.2 mp -54.99 -39.19 68.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.193 -0.458 . . . . 74.53 110.931 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 109.89 19.91 7.91 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.706 -0.759 . . . . 70.04 112.432 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.68 152.37 17.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.901 0.381 . . . . 75.21 110.829 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.46 136.93 10.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.129 -0.487 . . . . 75.24 110.896 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.4 93.05 0.27 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 72.14 110.83 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -172.55 105.34 0.16 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.22 -0.446 . . . . 71.44 110.92 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 47.6 t -109.47 113.68 26.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 73.41 110.781 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 56.8 p -59.72 -174.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.535 . . . . 75.22 110.824 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -163.96 113.3 1.23 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.099 -0.5 . . . . 75.3 110.868 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 12.2 t -119.99 88.33 2.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 75.35 110.912 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -75.09 149.25 39.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 64.25 110.881 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.98 129.14 19.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.097 -0.501 . . . . 65.31 110.911 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.42 163.62 14.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 73.44 110.851 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -64.06 -14.98 58.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.074 -0.512 . . . . 74.34 110.86 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -37.34 79.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 73.1 110.86 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -98.11 -18.21 18.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.103 -0.499 . . . . 74.1 110.893 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -151.47 78.06 7.1 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.65 0.738 . . . . 75.24 110.923 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -5.95 17.39 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.681 2.254 . . . . 73.32 112.382 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.6 t -93.32 27.5 2.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.113 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 31.3 mt -101.45 136.82 40.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 72.23 110.894 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.5 t -106.03 173.55 6.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 74.13 111.09 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -49.4 -37.77 26.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 75.54 110.873 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -60.91 -53.02 62.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 53.23 110.912 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -62.93 -52.44 63.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.195 -0.457 . . . . 74.54 110.91 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 41.9 mm -55.9 -53.92 32.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.11 -0.496 . . . . 75.4 111.154 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 60.5 p -58.71 -21.8 55.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 75.42 110.86 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.23 4.09 24.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 71.51 111.101 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.9 mtm -115.0 14.14 17.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.458 . . . . 73.12 110.935 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 11.6 t -109.46 -38.49 5.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.14 -1.391 . . . . 65.21 110.779 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.77 132.67 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.465 . . . . 63.55 110.806 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 20.7 m -52.47 125.64 6.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.042 -0.527 . . . . 73.23 111.13 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -130.59 76.34 1.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 75.31 110.841 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -57.85 160.62 7.92 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.601 0.715 . . . . 74.3 110.859 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 112.22 3.02 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.669 2.246 . . . . 75.22 112.342 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 CA-C-O 119.095 -0.836 . . . . 74.12 112.409 -179.962 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 CA-C-O 121.396 0.442 . . . . 73.14 112.462 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -19.9 35.59 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.664 2.243 . . . . 73.24 112.322 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.12 -22.91 8.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 74.22 110.909 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -51.99 -36.82 43.77 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.701 -0.761 . . . . 72.33 112.525 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -130.0 44.99 2.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.845 0.355 . . . . 75.42 110.781 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 28.3 mtt -151.76 74.22 7.88 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.623 0.725 . . . . 73.34 110.948 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -7.62 21.52 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.724 2.283 . . . . 73.05 112.347 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 42.9 p-90 -99.98 -29.81 12.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.221 -0.445 . . . . 74.42 110.832 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -85.78 99.3 11.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.261 -0.427 . . . . 65.34 110.895 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.88 -37.0 59.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 73.33 110.796 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.61 19.61 35.52 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.722 -0.752 . . . . 62.34 112.509 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.65 80.51 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.7 0.286 . . . . 73.22 110.82 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 27.2 mm -145.12 144.99 21.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.277 -0.419 . . . . 64.21 111.175 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.3 p -100.38 177.09 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.214 -0.448 . . . . 71.14 111.216 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 64.1 ttt-85 -63.75 -41.22 98.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 71.42 110.858 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.36 -36.79 83.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.435 . . . . 74.45 110.914 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.25 -39.8 59.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 71.32 110.969 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.46 -33.94 65.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 71.41 111.074 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -65.0 -53.34 47.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.445 . . . . 72.24 110.887 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -35.55 81.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.46 . . . . 74.23 110.891 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.55 -35.43 77.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 74.14 110.926 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -105.48 43.38 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.11 110.951 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.476 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.98 -60.21 4.56 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.748 0.785 . . . . 62.54 110.933 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.3 Cg_endo -69.79 123.64 10.29 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.663 2.242 . . . . 73.23 112.343 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.8 117.57 5.16 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.717 2.278 . . . . 71.24 112.392 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -154.72 110.3 3.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.889 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.1 p -61.98 111.88 2.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 75.02 111.114 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.68 -6.88 6.2 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 73.13 112.491 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.7 tp -90.72 111.79 23.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.855 0.36 . . . . 74.1 110.859 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 18.9 p90 -123.12 167.63 13.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 73.42 110.879 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -163.39 137.13 5.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.114 -0.494 . . . . 73.21 110.883 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 90.1 t -110.4 135.16 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 74.35 111.143 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -149.1 140.51 23.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 73.43 110.888 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -50.96 124.01 10.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.437 . . . . 75.44 110.857 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.7 t -55.44 119.38 5.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 73.24 110.866 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 94.1 m -70.15 -56.15 7.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 71.12 111.111 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -63.42 -42.64 98.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.255 -0.43 . . . . 70.14 110.871 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -106.01 96.08 12.24 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.621 0.724 . . . . 74.42 110.923 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 122.21 8.88 Favored 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 122.647 2.232 . . . . 74.23 112.342 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.75 -9.64 23.57 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.757 -0.735 . . . . 74.23 112.479 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -118.64 176.89 5.05 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.768 0.318 . . . . 70.11 110.925 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -124.13 158.68 31.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.285 -0.416 . . . . 74.11 110.93 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.5 m -132.19 121.67 24.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 74.53 111.194 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.01 116.84 29.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 73.24 110.916 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 1.8 t -102.33 125.53 49.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.278 -0.419 . . . . 64.34 110.811 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.1 t -125.68 151.39 31.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 63.12 111.141 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.06 112.07 24.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.476 . . . . 75.53 110.843 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.55 94.36 4.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 75.23 110.904 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 66.56 29.15 9.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.33 110.925 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 98.0 -14.3 62.79 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.7 -0.762 . . . . 72.12 112.523 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.88 139.65 30.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.806 0.336 . . . . 71.33 110.973 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 6.2 m -98.84 99.68 9.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.289 -0.414 . . . . 75.11 111.157 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -86.67 123.75 32.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 73.24 110.915 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 53.6 m-70 -101.38 127.15 48.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.118 -0.492 . . . . 75.15 110.946 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -113.48 106.23 14.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 71.43 110.933 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -58.26 137.25 57.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 73.53 110.902 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 61.8 mt -117.97 107.31 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 75.35 111.163 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.77 126.68 31.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 73.33 110.874 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -113.88 114.62 26.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.456 . . . . 74.43 110.936 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -149.72 138.37 20.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.137 -0.483 . . . . 74.23 110.922 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 53.66 35.83 22.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 64.41 111.094 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.72 28.81 16.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 63.53 110.863 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -129.36 140.1 51.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 74.35 110.847 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.8 mp -105.51 147.22 28.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 65.14 110.883 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 28.0 t -164.45 139.17 5.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 75.01 110.874 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 46.2 mt -115.53 -40.85 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.145 -0.48 . . . . 74.05 111.152 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.7 p30 -83.86 -7.02 59.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 71.34 110.882 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 61.79 16.12 7.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.187 -0.46 . . . . 73.4 110.889 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -123.23 -11.29 7.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 71.03 110.916 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -143.07 104.36 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.156 -0.474 . . . . 75.1 111.118 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -92.58 144.68 25.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.23 110.885 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -115.17 175.37 5.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.096 -0.502 . . . . 75.03 110.868 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.34 -13.92 18.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 54.11 110.932 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -168.7 171.84 8.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 65.11 110.883 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 mp -73.87 -24.02 59.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 70.32 110.908 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -59.6 -56.89 16.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 74.51 110.889 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -68.08 -36.5 79.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 72.11 110.885 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.47 -52.98 61.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.245 -0.434 . . . . 74.11 110.968 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 56.9 t -62.61 -36.22 74.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.116 -0.493 . . . . 74.32 111.133 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -55.33 -39.49 70.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 74.45 110.883 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -71.89 -50.3 30.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 74.25 110.838 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -62.71 -22.32 66.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 74.04 110.95 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 89.1 m -86.38 -27.13 24.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 72.13 111.166 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 90.0 m -79.4 -23.66 43.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 74.4 111.095 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.76 165.45 23.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.249 -0.432 . . . . 64.24 110.892 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.27 -58.3 6.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.46 . . . . 74.53 111.101 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 58.65 21.38 8.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.119 -0.491 . . . . 70.34 110.814 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 106.75 16.69 13.39 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.692 -0.766 . . . . 75.33 112.465 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.6 mp -107.3 140.31 40.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.833 0.349 . . . . 73.41 110.933 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 48.6 t -51.78 -29.89 20.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 73.2 110.912 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.7 t -159.4 123.58 3.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 75.54 111.176 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.96 146.16 6.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 73.12 110.884 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.3 mt -65.0 136.68 57.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 75.22 110.903 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 28.1 mt -127.06 -51.23 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.273 -0.421 . . . . 72.24 111.167 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.21 119.63 19.73 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.659 0.742 . . . . 74.43 110.851 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 140.76 43.39 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.73 2.287 . . . . 71.23 112.361 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.67 82.72 0.61 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 72.53 110.891 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 26.8 m -64.89 129.03 28.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.411 . . . . 64.2 111.079 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.9 ptm . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 72.12 110.853 179.912 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 CA-C-O 121.484 0.491 . . . . 75.24 112.53 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 129.45 17.69 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.707 2.271 . . . . 74.51 112.366 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 70.74 -70.63 0.15 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.325 -0.398 . . . . 75.13 110.895 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 92.87 19.65 36.27 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.754 -0.736 . . . . 64.43 112.494 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.76 142.52 32.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.945 0.403 . . . . 72.32 110.843 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -150.3 160.45 43.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.503 . . . . 74.13 110.907 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.02 146.67 10.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 72.32 110.888 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -148.14 85.42 1.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 71.2 110.88 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 6.0 p -179.36 70.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 73.23 110.841 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 49.2 m -115.22 79.44 1.28 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.107 -0.497 . . . . 72.32 110.843 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -143.23 117.83 9.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 72.21 110.911 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 9.4 t -123.03 88.07 2.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 74.41 110.795 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -76.19 149.06 37.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.107 -0.497 . . . . 73.55 110.937 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -158.2 129.73 6.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 74.45 110.884 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.13 175.83 5.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.245 -0.434 . . . . 62.41 110.873 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 26.5 mtt180 -64.48 -15.67 61.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 73.01 110.864 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -41.83 99.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 71.13 110.906 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -104.2 -10.38 17.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.099 -0.5 . . . . 62.44 110.937 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -158.15 78.6 3.33 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.598 0.713 . . . . 75.51 110.872 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -6.12 17.81 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.697 2.264 . . . . 61.25 112.344 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.9 t -93.18 27.18 2.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.246 -0.434 . . . . 73.4 111.102 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 31.2 mt -105.1 137.97 42.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.436 . . . . 72.13 110.894 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.5 t -103.66 173.46 6.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 72.22 111.209 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -50.33 -32.83 18.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 73.42 110.918 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.83 -47.64 74.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 64.12 110.855 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -67.42 -52.35 40.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 75.13 110.904 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 46.0 mm -55.94 -46.79 80.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 70.23 111.152 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 27.9 p -72.06 -17.03 62.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.855 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.39 2.42 32.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 65.22 111.17 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -115.12 14.21 16.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 65.54 110.902 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -97.95 -34.52 10.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.083 -1.417 . . . . 74.12 110.849 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 65.15 151.05 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 72.42 110.874 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 6.7 m -51.47 122.58 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 74.2 111.132 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -135.26 76.7 1.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 75.22 110.927 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -55.22 160.33 3.47 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.618 0.723 . . . . 73.21 110.877 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 113.1 3.26 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.593 2.196 . . . . 63.15 112.409 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 CA-C-O 119.123 -0.821 . . . . 74.21 112.518 -179.989 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 CA-C-O 121.408 0.449 . . . . 74.33 112.532 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 -45.38 1.64 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.613 2.208 . . . . 71.03 112.414 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -105.62 -26.84 11.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.208 -0.451 . . . . 73.13 110.993 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 137.33 -71.7 0.46 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.752 -0.737 . . . . 75.13 112.522 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 19.3 m -140.16 61.19 1.53 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.919 0.39 . . . . 74.33 110.872 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 mtt -130.42 74.08 80.62 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.593 0.711 . . . . 73.4 110.901 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 -7.86 22.14 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.702 2.268 . . . . 62.41 112.378 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -101.94 -29.37 11.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 75.43 110.898 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -85.59 99.56 11.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 75.13 110.818 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -75.88 -38.77 57.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 71.31 110.831 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.34 20.66 45.25 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.736 -0.745 . . . . 42.12 112.502 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 179.38 66.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 75.22 110.932 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.3 mm -129.58 144.74 37.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.443 . . . . 75.41 111.106 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.33 176.98 5.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.19 -0.459 . . . . 73.21 111.144 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -38.25 86.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 74.51 110.858 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.87 -33.63 62.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.445 . . . . 63.45 110.847 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -73.54 -41.33 63.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.24 110.832 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.32 -33.65 61.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 74.52 111.097 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -62.16 -53.47 54.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 73.23 110.863 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -38.49 91.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.12 110.892 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.5 mt -54.99 -38.91 68.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.181 -0.463 . . . . 75.51 110.905 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -101.26 43.7 1.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 72.31 110.892 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.487 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -66.89 -59.46 7.72 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.656 0.741 . . . . 72.44 110.978 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.81 123.11 9.76 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.697 2.264 . . . . 74.5 112.312 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 119.1 6.1 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.683 2.255 . . . . 73.52 112.34 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -155.09 108.99 2.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 74.31 110.95 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -60.92 117.17 5.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 64.31 111.153 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 123.83 -6.49 8.96 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.734 -0.746 . . . . 72.51 112.493 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 tp -91.2 116.02 28.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 70.43 110.869 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 14.9 p90 -128.25 163.38 24.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 74.24 110.866 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.1 pp -161.18 134.83 6.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.494 . . . . 74.23 110.886 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 87.0 t -109.65 136.03 46.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 73.43 111.133 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -147.13 144.24 28.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 74.34 110.874 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -51.66 124.19 11.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.471 . . . . 75.1 110.88 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 m -57.22 116.05 3.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 63.03 110.806 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 78.8 m -69.31 -56.39 7.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.103 -0.499 . . . . 73.44 111.115 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 21.3 p30 -71.7 -26.57 62.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.238 -0.437 . . . . 72.23 110.866 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.71 90.24 7.23 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.768 0.794 . . . . 73.23 110.886 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 112.32 3.05 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.671 2.247 . . . . 75.12 112.336 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.58 6.0 21.95 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.718 -0.753 . . . . 54.41 112.502 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -136.16 178.76 6.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.829 0.347 . . . . 71.25 110.871 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 99.2 m-85 -128.58 160.48 32.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.446 . . . . 75.13 110.948 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 93.4 m -131.68 140.27 49.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 52.44 111.137 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.13 120.59 42.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 72.53 110.859 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 3.8 t -103.36 126.19 50.39 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.144 -0.48 . . . . 75.05 110.923 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.3 t -128.06 146.3 33.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.1 111.107 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.41 110.43 22.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 61.14 110.896 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.49 94.05 4.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.135 -0.484 . . . . 73.34 110.913 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 66.92 28.81 8.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 74.22 110.828 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.75 -16.22 60.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.732 -0.747 . . . . 44.13 112.503 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -87.99 139.78 30.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.839 0.352 . . . . 75.32 110.888 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 11.4 m -98.06 110.3 25.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 75.13 111.117 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -97.03 113.62 25.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 72.52 110.828 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -90.77 124.76 35.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 65.23 110.848 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -115.54 108.93 17.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 71.22 110.935 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.02 142.54 58.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.14 -0.482 . . . . 73.55 110.834 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 30.8 mt -122.59 111.66 31.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.215 -0.448 . . . . 74.35 111.152 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -84.1 130.11 34.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 72.23 110.833 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -114.32 100.75 8.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 73.25 110.92 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -134.4 142.57 47.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 74.15 110.852 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.9 37.69 28.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.129 -0.487 . . . . 64.0 111.08 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.73 31.59 21.33 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.983 0.421 . . . . 71.13 110.89 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 4.0 mtmm -138.41 143.34 39.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.099 -0.5 . . . . 74.51 110.83 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.4 mp -104.25 151.67 23.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.25 110.953 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -169.4 144.99 3.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.238 -0.437 . . . . 75.22 110.839 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 47.8 mt -115.61 -37.83 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.103 -0.499 . . . . 74.13 111.122 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 9.8 p30 -88.77 -0.3 57.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 72.43 110.896 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 60.93 17.35 7.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.23 -0.441 . . . . 73.42 110.905 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -125.27 -32.48 2.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 73.42 110.864 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -113.65 104.62 17.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 71.51 111.081 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -97.74 143.86 27.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 74.34 110.97 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -119.06 175.18 5.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.05 -0.523 . . . . 74.23 110.886 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.05 -16.38 20.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 74.34 110.912 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -172.49 159.71 4.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 65.53 110.895 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.21 -39.19 59.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 71.3 110.978 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.8 ttt -51.03 -49.74 59.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.872 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -66.93 -39.85 87.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 73.24 110.941 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.07 -50.69 71.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 75.51 110.912 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 96.8 t -57.95 -44.24 86.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 74.11 111.108 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -53.27 -40.17 64.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 73.11 110.954 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -52.96 17.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.17 -0.468 . . . . 73.44 110.894 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -62.27 -17.48 58.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 72.11 110.893 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 80.9 m -85.91 -32.81 21.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 64.33 111.152 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 3.2 m -82.12 -16.3 50.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 75.04 111.154 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -177.38 131.85 0.17 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 74.41 110.872 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.3 -58.45 5.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 74.25 111.077 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 50.86 37.93 18.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 74.23 110.855 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 129.76 0.45 5.67 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.728 -0.748 . . . . 71.32 112.461 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -106.73 139.58 40.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.835 0.35 . . . . 74.11 110.975 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 53.7 t -56.79 -21.72 30.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 74.15 110.893 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.8 t -162.2 116.36 1.84 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.143 -0.48 . . . . 71.21 111.119 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.41 138.02 13.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 73.34 110.864 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 8.4 mt -61.34 126.71 28.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.441 . . . . 75.44 110.848 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 51.3 mt -109.71 -51.49 6.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 75.4 111.112 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? -136.77 139.71 29.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.562 0.696 . . . . 75.14 110.858 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.82 139.46 40.08 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.631 2.221 . . . . 65.54 112.276 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.54 84.3 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 74.12 110.885 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 29.2 m -63.95 131.01 29.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 65.14 111.106 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.5 ptt? . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 64.34 110.923 179.841 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 CA-C-O 121.471 0.484 . . . . 74.3 112.521 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 170.0 17.55 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.677 2.251 . . . . 71.0 112.334 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 42.6 mt -55.34 -45.52 76.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 74.53 110.916 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 104.15 20.52 10.36 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.734 -0.746 . . . . 54.41 112.43 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 67.0 m -127.57 139.35 52.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.885 0.374 . . . . 34.33 110.861 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -158.74 128.76 5.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 74.44 110.886 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -133.9 121.97 22.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 71.24 110.884 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -178.92 133.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 75.15 110.889 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 1.8 m -126.15 85.11 2.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.507 . . . . 75.13 110.856 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 97.5 p -60.25 -171.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.111 -0.495 . . . . 73.01 110.812 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.66 116.72 2.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 73.31 110.889 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 10.3 t -101.71 87.87 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 71.4 110.902 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -83.53 119.53 24.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 74.22 110.863 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -120.72 128.52 53.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 75.22 110.939 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.22 172.63 8.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 75.34 110.913 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 51.3 mtt180 -62.52 -16.41 55.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 74.44 110.838 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -37.78 84.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 64.01 110.893 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -104.01 -23.9 13.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 73.52 110.854 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -143.28 78.89 14.57 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.619 0.723 . . . . 73.32 110.857 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -6.16 17.94 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.663 2.242 . . . . 70.21 112.35 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.7 t -93.64 27.58 2.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 71.04 111.119 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 36.8 mt -100.7 147.73 25.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 72.32 110.979 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.3 t -113.31 173.77 6.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 74.44 111.122 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -48.81 -36.91 17.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.204 -0.453 . . . . 72.32 110.9 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -62.45 -49.89 73.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 74.22 110.9 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -64.12 -48.72 75.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 73.4 110.834 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 42.5 mm -61.94 -35.65 69.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 73.14 111.111 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 10.8 t -77.51 -15.71 59.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 64.34 110.813 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.41 3.62 27.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.135 -0.484 . . . . 74.23 111.082 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -115.16 14.24 16.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 75.11 110.904 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 3.5 t -100.28 -30.04 12.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 114.1 -1.409 . . . . 72.34 110.845 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 64.16 156.77 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 74.31 110.818 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 6.0 m -50.86 118.62 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 74.13 111.092 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -136.75 85.34 2.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.471 . . . . 72.33 110.866 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -70.77 153.92 94.59 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.519 0.676 . . . . 71.25 110.94 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 114.22 3.64 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.639 2.226 . . . . 75.25 112.353 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 CA-C-O 119.151 -0.805 . . . . 74.33 112.472 179.977 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 CA-C-O 121.39 0.439 . . . . 73.41 112.419 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -49.35 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.674 2.249 . . . . 65.32 112.367 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 54.8 mt -109.19 63.06 0.6 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.453 . . . . 75.44 110.84 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.27 56.29 3.66 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.712 -0.756 . . . . 62.32 112.49 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 6.4 p 178.92 33.87 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.924 0.392 . . . . 72.43 110.847 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -150.39 81.54 6.62 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.51 0.672 . . . . 71.41 110.887 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 -8.16 22.9 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.679 2.253 . . . . 54.21 112.334 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 56.1 p-90 -81.88 -18.79 42.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.218 -0.446 . . . . 74.34 110.911 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -97.59 99.28 10.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.44 . . . . 74.51 110.889 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -75.99 -39.48 55.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 73.31 110.871 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 56.84 22.25 40.3 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 75.45 112.508 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.21 69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.773 0.32 . . . . 61.34 110.886 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 11.6 mm -133.12 144.44 36.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 74.22 111.125 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.18 168.89 9.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.15 -0.477 . . . . 73.01 111.105 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -58.93 -39.49 81.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.9 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -71.37 -35.62 71.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 74.02 110.963 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -72.93 -40.47 65.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.072 -0.513 . . . . 73.53 110.96 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.63 -33.74 60.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 73.04 111.138 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -61.67 -53.09 60.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.244 -0.434 . . . . 75.53 110.845 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -38.21 90.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.89 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.1 mt -55.62 -38.07 69.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.479 . . . . 73.43 110.967 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -100.0 43.27 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 73.44 110.933 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.486 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.62 -59.87 5.27 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.686 0.755 . . . . 63.13 110.942 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.2 Cg_endo -69.77 123.56 10.22 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.705 2.27 . . . . 73.03 112.332 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 116.87 4.76 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.719 2.28 . . . . 71.31 112.37 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -154.98 109.33 2.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 72.11 110.9 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.09 111.64 2.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 73.5 111.164 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 131.03 -9.21 5.71 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.797 -0.716 . . . . 60.32 112.514 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -87.32 111.65 21.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.873 0.368 . . . . 74.32 110.885 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -123.59 163.63 20.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 74.22 110.908 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -160.45 135.74 7.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.16 -0.473 . . . . 72.44 110.917 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 87.8 t -109.97 137.04 44.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.236 -0.438 . . . . 74.54 111.063 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.7 ptt180 -150.15 144.4 25.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 73.32 110.867 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -54.9 125.71 21.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.484 . . . . 62.02 110.863 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.96 116.57 2.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 74.35 110.795 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.5 m -69.95 -29.88 67.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 75.2 111.111 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -102.53 0.35 33.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 73.53 110.881 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.402 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -139.7 94.88 9.04 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.657 0.742 . . . . 71.2 110.965 -179.925 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.7 Cg_endo -69.79 113.02 3.24 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.673 2.249 . . . . 75.52 112.354 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.8 -8.87 23.64 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.718 -0.753 . . . . 64.05 112.418 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.09 163.97 15.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.833 0.349 . . . . 75.11 110.87 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -118.32 160.08 22.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 71.41 110.953 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.6 m -137.02 127.94 27.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 73.14 111.141 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.58 125.06 46.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 73.42 110.973 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 17.9 t -109.24 124.26 50.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.225 -0.443 . . . . 71.34 110.899 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.1 t -123.5 153.39 29.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.471 . . . . 75.1 111.121 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -104.93 112.49 25.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 44.31 110.879 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.78 94.59 4.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.457 . . . . 54.45 110.926 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 67.16 29.67 7.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 70.41 110.971 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.74 -14.1 63.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.747 -0.739 . . . . 74.1 112.514 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.69 141.05 28.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 74.11 110.876 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 9.0 m -100.83 111.1 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 74.54 111.149 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -102.23 123.97 46.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 74.1 110.854 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -101.15 132.18 46.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 75.22 110.902 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -116.17 122.73 45.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 71.44 110.921 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -72.17 136.02 46.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 74.41 110.909 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 54.1 mt -117.74 107.08 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 74.14 111.137 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -83.0 128.78 34.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.448 . . . . 71.4 110.896 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -113.7 103.04 10.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.442 . . . . 75.43 110.917 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -140.85 142.64 34.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 73.43 110.847 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.72 39.6 24.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 75.41 111.095 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 56.96 25.15 10.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 64.53 110.864 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.8 mtmm -132.0 152.75 50.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 75.54 110.874 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.1 mt -115.86 150.49 36.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.434 . . . . 75.12 110.92 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 7.9 t -168.4 145.35 3.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 72.54 110.852 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 35.4 mt -115.61 -32.09 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 75.41 111.089 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -89.37 1.61 55.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 70.21 110.8 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 60.31 18.18 7.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 72.55 110.852 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -132.22 -38.81 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 75.41 110.931 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.3 t -100.73 104.72 16.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 74.14 111.156 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -100.84 141.11 34.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 74.21 110.946 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -116.66 173.97 6.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 72.34 110.85 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.28 -17.56 22.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.094 -0.503 . . . . 74.24 110.941 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -170.49 158.71 6.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.08 -0.509 . . . . 71.2 110.877 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -39.42 63.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 72.34 110.925 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.9 ttt -51.29 -47.92 62.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 75.32 110.858 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -68.23 -41.59 81.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.918 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.93 -48.56 75.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 74.11 110.905 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.81 -40.23 86.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 74.21 111.165 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -56.67 -38.44 72.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.493 . . . . 74.52 110.864 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -51.13 25.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 73.21 110.821 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -64.28 -20.94 66.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 72.43 110.925 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 85.1 m -84.44 -29.48 26.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.118 -0.492 . . . . 71.02 111.122 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 89.0 m -79.44 -24.24 42.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.429 . . . . 74.11 111.167 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -162.54 166.15 25.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 70.41 110.907 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.89 -55.62 16.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 74.53 111.121 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 59.03 21.62 9.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.282 -0.417 . . . . 72.42 110.837 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 107.62 13.66 19.88 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.76 -0.733 . . . . 62.22 112.544 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.9 mp -108.15 136.25 48.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.882 0.372 . . . . 71.33 110.891 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 26.3 t -51.48 -30.25 19.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 70.05 110.942 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.9 t -151.65 119.39 6.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 64.02 111.195 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.76 153.24 2.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.256 -0.429 . . . . 75.51 110.953 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 6.3 mt -69.44 133.44 47.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.431 . . . . 75.4 110.996 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 22.4 mt -127.2 -51.23 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 72.22 111.158 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt -126.2 118.92 23.51 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.579 0.704 . . . . 75.11 110.892 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 131.91 22.31 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.712 2.275 . . . . 73.54 112.375 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 83.67 0.53 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 73.3 110.872 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 31.6 m -64.71 144.92 14.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.44 . . . . 75.23 111.162 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 72.41 110.872 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 CA-C-O 121.486 0.492 . . . . 63.32 112.458 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 169.44 18.85 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.711 2.274 . . . . 75.4 112.37 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.86 -42.33 71.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.222 -0.445 . . . . 74.1 110.91 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 78.52 20.76 70.96 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.677 -0.773 . . . . 72.53 112.559 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 2.7 p -84.62 109.14 17.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 74.5 110.807 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 14.5 mttm -153.74 133.98 13.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.128 -0.487 . . . . 64.53 110.958 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -177.88 145.69 0.4 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.254 -0.43 . . . . 74.03 110.827 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -161.55 78.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 71.12 110.915 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -178.98 79.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.143 -0.48 . . . . 75.31 110.869 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.72 111.98 6.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 74.11 110.845 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -164.05 108.96 1.01 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.173 -0.467 . . . . 75.33 110.994 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 11.1 p -105.35 88.61 2.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 75.34 110.809 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -81.63 151.13 27.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.141 -0.481 . . . . 75.04 110.973 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.2 129.22 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 71.31 110.855 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.08 159.28 15.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 73.04 110.831 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 45.4 mtt180 -60.15 -18.48 47.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.094 -0.503 . . . . 74.12 110.873 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.05 -43.41 87.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 74.04 110.863 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.37 -23.18 17.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 70.12 110.918 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -144.52 77.45 13.82 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.624 0.726 . . . . 74.4 110.819 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.84 -5.8 17.12 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.703 2.268 . . . . 73.31 112.3 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.3 t -92.63 27.52 2.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.232 -0.44 . . . . 73.04 111.207 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 24.4 mt -103.92 136.71 43.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 73.25 110.88 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.1 t -104.5 171.99 7.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 75.35 111.149 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -49.35 -36.82 22.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.272 -0.422 . . . . 74.43 110.885 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.86 -52.08 66.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.197 -0.456 . . . . 73.23 110.932 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -64.15 -52.56 58.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.474 . . . . 73.01 110.932 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 48.0 mm -55.85 -54.52 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 74.51 111.208 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 33.3 t -59.43 -21.38 59.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 73.43 110.872 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.14 3.9 25.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 72.25 111.143 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.2 mtm -115.58 14.33 16.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 73.4 110.87 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.43 -35.98 6.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.139 -1.391 . . . . 74.25 110.868 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.4 m 66.49 136.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 75.31 110.922 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 5.8 m -51.25 121.97 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 72.45 111.142 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -128.4 78.41 1.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 64.53 110.86 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 23.7 mtmt -60.31 160.45 17.54 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.655 0.74 . . . . 75.32 110.844 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 112.3 3.04 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.628 2.219 . . . . 74.05 112.425 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 CA-C-O 119.143 -0.809 . . . . 60.13 112.488 179.979 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 CA-C-O 121.458 0.477 . . . . 75.41 112.462 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.79 -39.94 5.86 Favored 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 122.653 2.236 . . . . 73.5 112.306 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.76 -29.65 5.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.288 -0.415 . . . . 74.22 110.918 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 158.43 -73.37 0.23 Allowed Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.714 -0.755 . . . . 72.23 112.46 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 18.6 m -132.89 59.58 1.73 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 71.3 110.814 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 32.9 mtt -146.1 68.1 12.43 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.567 0.699 . . . . 75.42 110.867 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -7.89 22.21 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.673 2.249 . . . . 72.21 112.272 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 38.9 p-90 -101.57 -30.51 11.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 74.45 110.909 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -86.41 99.09 11.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.41 . . . . 74.13 110.886 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -76.56 -40.39 49.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 73.54 110.903 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.83 24.86 54.98 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 75.23 112.506 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.96 66.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.743 0.306 . . . . 74.33 110.899 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 14.2 mm -129.74 144.32 38.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 74.02 111.131 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.49 170.49 9.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 72.41 111.105 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -60.9 -39.45 89.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 75.42 110.82 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -74.05 -33.78 63.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 73.33 110.9 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -70.82 -40.83 72.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 74.14 110.926 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.18 -34.13 61.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 73.33 111.135 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -60.07 -52.98 63.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 75.04 110.861 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.75 -36.35 82.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 75.43 110.929 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 11.1 mt -55.01 -38.26 67.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.131 -0.486 . . . . 72.5 110.92 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -102.03 43.76 1.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 71.4 110.929 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.49 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.54 -59.68 6.67 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.631 0.729 . . . . 74.22 110.897 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.81 123.61 10.25 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.64 2.227 . . . . 75.4 112.373 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 116.82 4.74 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.674 2.249 . . . . 71.03 112.351 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -154.87 115.16 3.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 72.35 110.939 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -66.6 111.69 3.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.166 -0.47 . . . . 73.52 111.165 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.19 -5.07 6.37 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.705 -0.759 . . . . 74.05 112.44 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.9 tp -90.6 113.15 25.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.838 0.352 . . . . 75.25 110.894 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 16.6 p90 -124.38 168.42 13.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 73.4 110.875 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -164.03 137.14 5.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 65.04 110.934 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 89.5 t -110.65 135.73 48.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 73.02 111.164 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -149.3 143.01 25.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 75.42 110.866 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -54.88 124.08 15.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.181 -0.463 . . . . 74.53 110.885 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.2 m -56.37 115.91 2.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.078 -0.51 . . . . 74.02 110.855 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.4 m -68.61 -56.28 8.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 72.55 111.13 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.0 p30 -68.19 -19.55 64.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 71.42 110.963 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.401 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 1.3 m-85 -124.75 93.15 46.61 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.673 0.749 . . . . 74.15 110.934 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 54.0 Cg_endo -69.71 119.84 6.72 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.668 2.245 . . . . 73.1 112.409 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.73 -10.45 23.42 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.792 -0.718 . . . . 62.43 112.473 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -119.46 -178.61 3.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.802 0.334 . . . . 71.11 110.838 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -130.59 162.15 29.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 70.43 110.885 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 96.4 m -130.32 125.33 34.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.111 -0.495 . . . . 75.33 111.195 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 30.2 tp -98.57 112.6 24.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.277 -0.419 . . . . 74.44 110.881 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.1 m -101.04 126.35 47.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 73.24 110.877 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.7 t -127.55 151.21 34.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 74.21 111.116 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.27 112.62 24.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 70.55 110.845 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.96 94.27 4.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 72.0 110.909 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 65.58 25.52 11.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.03 110.897 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.9 8.85 55.19 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 51.03 112.535 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -110.55 139.09 46.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.768 0.318 . . . . 74.52 110.874 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 69.3 t -95.17 101.21 12.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 75.14 111.162 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -90.24 110.23 21.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 73.55 110.88 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -89.03 124.52 34.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 74.32 110.84 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -113.93 104.49 12.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 72.22 110.908 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -53.76 133.66 42.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.08 -0.509 . . . . 74.02 110.845 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 65.2 mt -113.13 106.95 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.456 . . . . 63.44 111.153 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.1 ttm -76.69 129.31 36.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 72.53 110.942 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -114.88 115.97 27.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 74.03 110.972 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -149.58 137.03 20.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 74.13 110.869 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.46 36.11 24.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 62.52 111.101 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.57 25.41 14.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 73.01 110.813 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -126.24 144.02 50.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 72.31 110.892 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.9 mp -106.5 150.7 25.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.258 -0.428 . . . . 73.42 110.913 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -168.26 134.84 2.0 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.184 -0.462 . . . . 74.43 110.855 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 50.0 mt -110.77 -33.48 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 75.2 111.138 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.42 ' O ' ' CG ' ' A' ' 142' ' ' GLU . 3.4 p30 -95.48 9.8 38.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.114 -0.494 . . . . 74.13 110.864 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 6.7 pt-20 45.48 31.29 0.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.54 110.973 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -131.86 -39.47 1.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.079 -0.51 . . . . 70.43 110.86 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.7 p -118.52 104.55 16.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 74.43 111.136 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -91.91 149.83 21.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 74.22 110.891 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -120.09 173.76 6.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 65.12 110.887 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -93.84 -18.19 22.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 72.44 110.886 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -172.05 158.7 4.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 64.11 110.888 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.19 -36.02 39.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 74.44 110.881 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.5 ttt -52.47 -51.14 60.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 74.4 110.928 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -65.99 -40.05 90.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 72.15 110.951 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.71 -49.71 72.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.212 -0.449 . . . . 73.21 110.927 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 96.5 t -59.04 -44.62 91.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 75.31 111.18 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -52.97 -38.99 62.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.102 -0.499 . . . . 70.55 110.837 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -53.43 16.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 70.22 110.882 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -62.65 -17.27 60.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 64.43 110.896 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 99.6 m -85.83 -32.46 21.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 72.25 111.15 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 16.2 m -79.68 -22.49 43.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 74.24 111.17 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -165.88 161.68 17.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 75.4 110.893 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.31 -58.35 6.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 72.52 111.108 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.01 16.6 9.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.256 -0.429 . . . . 52.51 110.873 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 115.3 1.45 21.95 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.695 -0.764 . . . . 71.22 112.467 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.41 140.39 29.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.801 0.334 . . . . 74.05 110.889 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 34.6 t -51.06 -30.56 16.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.201 -0.454 . . . . 73.12 110.848 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.6 t -158.66 125.11 4.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.246 -0.434 . . . . 75.14 111.183 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -50.77 146.22 6.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 74.44 110.857 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.3 mt -65.04 134.78 54.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 74.31 110.899 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 25.1 mt -127.13 -51.17 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 63.23 111.11 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.77 118.82 21.19 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.556 0.693 . . . . 75.41 110.904 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 141.96 46.81 Favored 'Trans proline' 0 C--O 1.232 0.215 0 C-N-CA 122.724 2.283 . . . . 73.41 112.375 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 82.51 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.237 -0.438 . . . . 74.32 110.923 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 13.5 m -65.0 124.76 20.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 75.1 111.124 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.2 ptm . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 74.22 110.887 179.911 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 CA-C-O 121.43 0.461 . . . . 70.35 112.473 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.86 169.65 18.55 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.673 2.249 . . . . 74.13 112.311 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.11 -44.98 64.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 74.12 110.928 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 103.44 -21.44 39.19 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.711 -0.757 . . . . 72.13 112.519 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.2 115.79 18.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.86 0.362 . . . . 64.2 110.867 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 22.8 mttt -147.68 146.85 29.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 74.44 110.953 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -150.64 101.65 2.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 72.22 110.932 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -175.11 137.24 0.4 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 74.14 110.868 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -174.13 141.35 0.75 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.482 . . . . 73.23 110.898 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 99.7 p -68.96 -171.96 0.35 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.111 -0.495 . . . . 65.31 110.905 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -152.22 104.39 2.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 74.35 110.94 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.2 t -96.65 88.64 4.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.161 -0.472 . . . . 63.35 110.885 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -77.66 147.87 35.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.495 . . . . 74.41 110.904 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -151.39 129.54 11.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 72.44 110.929 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.84 175.0 5.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 74.31 110.843 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 36.4 mtt180 -64.24 -15.5 60.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.094 -0.503 . . . . 74.31 110.842 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.16 -42.75 99.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 75.03 110.836 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -102.43 -10.75 19.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.165 -0.47 . . . . 74.32 110.931 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -156.83 77.62 4.06 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.592 0.71 . . . . 72.42 110.862 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -6.26 18.18 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.712 2.275 . . . . 63.05 112.337 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.8 t -93.31 27.15 2.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 75.34 111.135 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 34.8 mt -103.98 136.84 42.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 74.11 110.947 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.7 t -103.4 174.24 5.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 74.52 111.13 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -49.87 -34.37 19.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 73.04 110.895 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.95 -48.95 72.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.482 . . . . 71.54 110.921 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -64.89 -52.22 57.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.074 -0.512 . . . . 75.43 110.872 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 43.9 mm -57.17 -53.28 45.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 72.22 111.145 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 46.8 m -63.67 -18.44 63.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 70.34 110.792 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.38 2.99 29.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 71.25 111.168 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.7 mtt -114.01 14.38 18.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 62.42 110.925 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 13.2 p -116.51 -26.61 7.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.127 -1.397 . . . . 73.12 110.903 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 62.86 161.56 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.098 -0.501 . . . . 63.1 110.814 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 15.3 m -68.6 134.47 30.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.108 -0.497 . . . . 64.05 111.15 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -132.14 74.38 1.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 73.02 110.91 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 34.1 mttt -67.43 153.72 94.34 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.595 0.712 . . . . 72.05 110.876 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 113.82 3.5 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.659 2.239 . . . . 75.31 112.378 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 CA-C-O 119.122 -0.821 . . . . 72.22 112.47 179.99 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 CA-C-O 121.433 0.463 . . . . 75.42 112.502 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -39.3 6.69 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.703 2.269 . . . . 74.32 112.34 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -151.24 27.18 0.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 75.1 110.862 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 159.41 -100.19 0.19 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.718 -0.753 . . . . 73.32 112.458 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 97.3 p -153.28 64.96 0.76 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.89 0.376 . . . . 73.55 110.872 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.89 73.94 78.82 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.599 0.714 . . . . 70.02 110.917 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -7.75 21.85 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.68 2.253 . . . . 74.04 112.325 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 39.0 p-90 -102.86 -31.01 10.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.271 -0.422 . . . . 75.34 110.892 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -86.44 102.06 13.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.24 110.893 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -76.25 -36.63 58.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 62.15 110.891 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.39 18.75 37.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.736 -0.745 . . . . 73.41 112.554 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.51 78.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 74.34 110.872 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 13.4 mm -139.21 144.28 29.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 75.2 111.103 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.11 176.01 6.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.103 -0.499 . . . . 75.52 111.195 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.5 ppt_? -65.44 -39.12 91.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.224 -0.444 . . . . 75.22 110.908 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -74.61 -33.07 62.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.165 -0.47 . . . . 62.4 110.883 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -71.77 -43.06 66.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 75.01 110.878 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.04 -33.82 61.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 72.32 111.126 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -60.25 -53.28 59.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 72.23 110.892 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -36.58 83.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.489 . . . . 73.31 110.892 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 12.0 mt -55.01 -38.18 67.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.188 -0.46 . . . . 74.22 110.88 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -102.03 43.75 1.05 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.228 -0.442 . . . . 71.31 110.917 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.485 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.62 -59.91 6.27 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.679 0.752 . . . . 74.44 110.975 179.933 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.485 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.7 Cg_endo -69.83 123.25 9.89 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.631 2.22 . . . . 73.33 112.326 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 117.58 5.17 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.677 2.251 . . . . 74.31 112.331 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -154.81 108.17 2.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.176 -0.465 . . . . 70.53 110.905 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.79 112.79 2.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 74.33 111.19 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.09 -6.9 6.39 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.745 -0.741 . . . . 63.44 112.495 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.13 115.44 27.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.855 0.36 . . . . 72.34 110.924 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -126.77 164.36 21.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 74.32 110.882 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -161.13 137.93 8.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 72.3 110.879 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.3 t -110.3 140.27 30.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 74.42 111.08 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -153.15 145.58 24.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 73.11 110.866 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.53 125.02 13.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 72.14 110.895 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.5 m -58.38 113.19 1.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 75.53 110.774 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.9 m -68.92 -56.27 8.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 63.24 111.097 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -65.02 -27.88 69.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 75.21 110.917 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -117.64 94.62 46.2 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.675 0.75 . . . . 75.24 110.927 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 118.09 5.48 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.656 2.237 . . . . 64.21 112.338 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.57 -1.32 24.85 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.757 -0.735 . . . . 62.44 112.485 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -129.06 -173.41 2.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.799 0.333 . . . . 73.12 110.872 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -134.52 166.61 22.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.88 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 57.6 m -138.38 141.6 39.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.098 -0.501 . . . . 72.25 111.14 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.96 118.23 35.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 75.32 110.949 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.5 m -101.59 125.92 48.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.44 . . . . 72.53 110.892 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.4 t -126.1 150.91 31.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 73.31 111.12 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.99 111.64 24.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.44 110.878 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.73 93.11 3.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.475 . . . . 75.24 110.931 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 66.81 29.8 8.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 74.34 110.936 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.9 -14.0 63.17 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.763 -0.732 . . . . 74.43 112.508 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -88.14 139.29 30.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 72.42 110.919 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 95.6 t -100.09 111.27 29.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.138 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -100.96 124.18 46.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 71.23 110.928 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -101.6 124.76 47.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 74.41 110.825 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -112.3 112.73 24.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.467 . . . . 71.53 110.968 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -62.2 139.27 58.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 73.54 110.883 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.2 mt -119.69 109.61 26.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 74.52 111.104 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.38 123.29 30.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 73.12 110.89 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -112.4 98.23 7.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 73.4 110.951 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -131.47 142.61 50.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 74.5 110.865 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.65 36.1 26.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 75.24 111.113 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.51 26.44 16.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 60.42 110.872 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -131.34 139.33 49.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 72.34 110.907 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.0 mp -102.08 150.46 23.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.465 . . . . 74.31 110.93 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -167.79 138.37 2.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 74.43 110.875 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 50.3 mt -112.93 -34.87 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 75.04 111.071 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.6 p30 -89.14 -1.67 58.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.254 -0.43 . . . . 74.33 110.853 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 61.12 17.49 8.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 74.4 110.805 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -127.21 -33.36 2.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.22 110.915 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -113.36 104.86 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 71.43 111.103 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -97.19 145.65 25.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 73.51 111.009 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -118.52 178.1 4.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 74.41 110.806 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.68 -15.63 17.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.112 -0.495 . . . . 74.34 110.912 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -165.48 172.2 12.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 74.24 110.871 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.71 -23.88 58.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 75.11 110.901 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -57.19 11.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 74.52 110.866 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -65.08 -35.33 80.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 73.31 110.908 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.57 -47.57 76.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.43 110.929 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 75.2 t -64.99 -39.48 85.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 72.21 111.142 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -54.43 -37.83 65.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.109 -0.496 . . . . 74.32 110.958 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.03 -44.84 62.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.107 -0.497 . . . . 72.4 110.88 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -67.96 -22.09 65.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.451 . . . . 75.2 110.898 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.5 m -84.24 -30.04 26.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 72.33 111.164 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 19.2 m -78.96 -25.83 43.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.213 -0.449 . . . . 74.44 111.118 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.66 161.68 29.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.194 -0.457 . . . . 52.2 110.868 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.1 -58.32 6.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.419 . . . . 64.43 111.103 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 60.2 19.51 8.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.459 . . . . 73.44 110.907 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 114.43 0.76 23.44 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.696 -0.764 . . . . 73.54 112.449 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -93.83 139.2 31.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.888 0.375 . . . . 75.41 110.918 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 36.0 t -51.27 -30.29 17.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 74.12 110.822 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.1 t -156.42 125.7 6.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 72.41 111.137 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -50.73 142.22 11.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.227 -0.442 . . . . 74.34 110.819 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 8.6 mt -64.31 134.62 55.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.14 -0.482 . . . . 75.44 110.847 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 28.8 mt -121.77 -51.25 3.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 72.4 111.112 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -132.42 126.36 20.19 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.595 0.712 . . . . 75.1 110.887 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.85 140.58 42.69 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.662 2.241 . . . . 64.44 112.343 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.09 83.48 0.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.274 -0.421 . . . . 75.35 110.931 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 29.1 m -64.46 129.91 28.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 75.42 111.173 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.4 ptt? . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 74.22 110.899 179.949 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 CA-C-O 121.469 0.483 . . . . 53.43 112.474 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 169.41 18.92 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.599 2.199 . . . . 74.54 112.352 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.54 -47.59 66.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.152 -0.476 . . . . 72.11 110.962 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 95.23 -21.13 45.91 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.733 -0.746 . . . . 44.41 112.511 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 5.6 p -53.44 130.8 36.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.979 0.418 . . . . 74.51 110.834 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -144.01 152.34 40.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.083 -0.508 . . . . 74.11 110.882 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.5 172.58 6.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.225 -0.443 . . . . 74.01 110.872 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -171.01 65.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 71.14 110.925 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 35.1 t -174.32 74.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.187 -0.461 . . . . 63.14 110.894 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 9.6 t -134.14 103.41 5.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 74.34 110.835 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -163.96 112.7 1.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 74.33 110.926 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.91 88.5 2.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 70.53 110.801 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -74.63 149.23 40.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.153 -0.476 . . . . 75.23 110.92 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -144.55 129.09 18.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.106 -0.497 . . . . 75.13 110.904 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.79 157.02 17.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 73.41 110.852 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -59.31 -18.94 42.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.093 -0.503 . . . . 75.42 110.869 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -36.65 84.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 72.4 110.85 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -97.7 -24.55 15.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 72.45 110.893 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -144.59 79.21 12.59 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.677 0.751 . . . . 72.54 110.915 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 -5.83 17.19 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.617 2.211 . . . . 71.5 112.326 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.0 t -93.24 27.43 2.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 75.53 111.145 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 29.2 mt -101.31 136.83 40.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.235 -0.439 . . . . 75.15 110.981 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.2 t -105.95 172.81 6.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 75.14 111.118 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -49.43 -37.34 25.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 65.43 110.924 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -60.75 -52.43 65.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 74.14 110.85 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -63.64 -52.39 60.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.475 . . . . 70.12 110.915 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 43.3 mm -55.83 -53.77 34.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 73.3 111.171 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 7.8 t -58.67 -22.84 58.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 73.52 110.855 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.54 4.28 25.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 64.42 111.054 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.4 mtm -113.88 8.86 17.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 72.54 110.894 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 21.2 p -109.07 -37.12 5.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.113 -1.403 . . . . 70.05 110.829 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 66.65 130.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 73.44 110.853 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 6.0 m -50.22 133.51 10.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 72.1 111.112 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.49 74.48 1.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 71.14 110.892 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.8 mttp -68.5 153.74 95.32 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.627 0.727 . . . . 74.54 110.911 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 114.12 3.6 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.721 2.28 . . . . 71.52 112.334 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 CA-C-O 119.102 -0.832 . . . . 73.2 112.505 -179.99 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 CA-C-O 121.444 0.469 . . . . 41.23 112.517 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 99.33 0.74 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.713 2.275 . . . . 74.2 112.339 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.04 -74.95 0.07 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 75.43 110.863 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 173.05 -41.72 0.16 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.714 -0.755 . . . . 74.21 112.527 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 69.1 p -130.83 56.25 1.8 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.867 0.365 . . . . 73.42 110.881 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.7 mtt -129.61 74.2 80.98 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.529 0.68 . . . . 73.41 110.832 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -7.0 19.96 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.693 2.262 . . . . 71.55 112.283 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 32.4 p-90 -101.51 -30.73 11.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.439 . . . . 75.11 110.888 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -89.91 108.1 19.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.419 . . . . 74.2 110.936 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 17.7 m-70 -83.44 -46.97 11.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 72.32 110.891 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.89 33.0 71.57 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.707 -0.759 . . . . 63.22 112.538 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.61 33.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.712 0.292 . . . . 74.15 110.922 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.4 mm -103.3 144.07 14.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.42 111.072 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.19 159.35 16.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.125 -0.488 . . . . 75.43 111.213 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -54.14 -37.94 64.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 74.43 110.904 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -77.15 -32.05 56.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.232 -0.44 . . . . 73.44 110.829 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -70.09 -39.49 75.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 72.03 110.915 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.99 -35.99 62.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 73.32 111.151 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -58.87 -52.85 63.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 54.52 110.927 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.75 -35.63 80.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.495 . . . . 74.11 110.862 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 11.5 mt -54.9 -38.49 67.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 74.54 110.926 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -98.46 43.67 1.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 74.03 110.949 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.49 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.72 -59.92 6.15 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.622 0.725 . . . . 75.34 110.912 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.9 Cg_endo -69.68 123.35 10.04 Favored 'Trans proline' 0 N--CA 1.465 -0.195 0 C-N-CA 122.73 2.287 . . . . 74.43 112.347 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 117.67 5.22 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.68 2.254 . . . . 75.31 112.333 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.9 105.29 2.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.217 -0.447 . . . . 75.52 110.862 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.64 111.9 1.42 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.127 -0.488 . . . . 64.11 111.11 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.32 -5.09 6.32 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.718 -0.753 . . . . 64.11 112.511 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.31 117.49 29.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.876 0.37 . . . . 74.23 110.924 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -128.5 166.79 18.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.164 -0.471 . . . . 72.31 110.885 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -164.23 138.72 5.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 74.41 110.874 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.9 t -109.92 131.19 61.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 73.54 111.211 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.26 145.71 41.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 71.2 110.879 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.76 123.92 8.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 74.14 110.893 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.5 m -62.16 109.3 1.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 62.23 110.856 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.5 m -68.69 -56.31 8.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 73.33 111.167 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . 0.456 ' ND2' ' HH ' ' B' ' 296' ' ' TYR . 67.2 m-80 -64.38 -27.04 68.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.196 -0.457 . . . . 72.4 110.823 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -118.43 95.73 49.03 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.677 0.751 . . . . 72.21 110.869 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 114.34 3.67 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.638 2.225 . . . . 64.33 112.368 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.41 -1.18 25.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.729 -0.748 . . . . 72.0 112.532 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -123.47 -172.97 2.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.789 0.328 . . . . 74.35 110.832 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -139.98 145.12 37.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.904 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.4 m -113.6 141.63 46.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 72.22 111.136 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.14 118.97 36.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.244 -0.434 . . . . 74.54 110.913 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 14.7 t -102.66 129.94 49.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.445 . . . . 73.24 110.85 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 11.7 t -128.53 150.01 33.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.03 111.092 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.12 112.45 25.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 74.41 110.895 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.13 91.46 3.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.116 -0.493 . . . . 70.24 110.862 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 66.35 32.21 7.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 73.0 110.896 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.34 -13.76 64.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.712 -0.756 . . . . 54.14 112.476 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.03 145.69 25.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.833 0.349 . . . . 75.33 110.909 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 6.8 m -106.08 116.38 49.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 74.11 111.166 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -107.28 122.8 47.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 74.53 110.822 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -99.78 124.16 44.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 62.32 110.804 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -110.8 116.99 32.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 54.14 110.881 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 129.73 40.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 75.55 110.78 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 33.3 mt -113.66 109.41 28.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 73.2 111.153 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -81.41 125.22 30.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 71.04 110.913 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -114.97 101.06 8.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.261 -0.427 . . . . 73.53 110.907 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -137.36 142.55 41.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 74.11 110.894 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.66 35.87 24.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 73.54 111.158 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 2.7 t 60.26 31.87 20.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 75.04 110.795 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mtmm -137.92 142.56 40.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.174 -0.466 . . . . 74.32 110.884 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mp -105.64 152.2 23.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 70.41 110.929 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -169.59 139.94 2.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.449 . . . . 73.45 110.816 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 58.4 mt -115.65 -37.14 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 74.33 111.145 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -89.19 -5.26 57.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 75.13 110.915 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 61.98 15.87 7.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 63.23 110.901 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -123.79 -9.19 7.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.074 -0.512 . . . . 74.24 110.896 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.5 t -143.48 104.53 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.101 -0.5 . . . . 62.52 111.073 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -94.99 145.47 24.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 54.33 110.89 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -117.09 178.05 4.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 73.45 110.869 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.68 -15.69 17.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 64.54 110.92 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -165.76 172.07 12.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 71.33 110.849 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.5 -23.26 58.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 74.44 110.894 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.5 ttp -62.55 -57.19 12.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 65.44 110.864 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -65.73 -35.66 81.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.456 . . . . 74.14 110.97 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.54 -48.46 74.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.466 . . . . 72.54 110.958 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 71.0 t -64.79 -38.01 81.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.489 . . . . 75.12 111.124 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -55.4 -38.32 68.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 74.12 110.904 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -72.22 -45.2 61.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.43 110.826 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -69.92 -15.82 63.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 75.1 110.968 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 96.8 m -86.96 -34.16 19.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.079 -0.509 . . . . 74.32 111.128 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.5 t -80.09 -23.45 41.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 60.04 111.164 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.25 153.65 24.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 64.35 110.855 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.51 -58.16 7.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 45.42 111.116 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 56.21 25.19 8.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 55.2 110.928 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 119.28 -11.3 11.5 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.742 -0.742 . . . . 71.42 112.483 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -86.93 138.38 31.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.896 0.379 . . . . 73.54 110.894 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 19.5 t -51.23 -29.51 14.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.141 -0.481 . . . . 73.01 110.856 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 4.5 t -158.99 128.13 5.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 72.4 111.095 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -51.62 139.53 20.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 75.45 110.928 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 8.5 mt -60.95 139.54 58.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.258 -0.428 . . . . 75.34 110.874 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 26.4 mt -127.13 -51.5 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 65.52 111.148 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -128.15 122.04 21.94 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.578 0.704 . . . . 74.32 110.932 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 138.45 37.99 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.753 2.302 . . . . 72.52 112.329 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.42 84.03 0.4 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 61.42 110.899 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 28.7 m -64.38 138.52 22.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.438 . . . . 71.52 111.174 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.1 ptm . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 75.45 110.844 179.992 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 CA-C-O 121.431 0.462 . . . . 72.44 112.445 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 169.88 17.9 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 73.52 112.321 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 10.4 mp -56.74 -41.6 77.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 73.42 110.87 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 73.37 30.57 62.33 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.779 -0.724 . . . . 71.11 112.471 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 5.8 t -78.29 73.5 4.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.962 0.41 . . . . 71.01 110.901 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 38.1 tttt -158.54 129.0 6.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.109 -0.496 . . . . 74.44 110.899 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -173.18 176.36 2.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 72.44 110.856 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -174.41 66.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 73.35 110.847 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 53.8 p -176.93 121.55 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.842 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.75 108.63 0.79 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.145 -0.479 . . . . 71.2 110.86 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -163.92 102.34 0.89 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.473 . . . . 73.34 110.899 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 4.4 p -96.72 88.88 4.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 61.53 110.859 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . 0.456 ' HH ' ' ND2' ' A' ' 111' ' ' ASN . 36.5 t80 -77.0 145.64 37.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.11 -0.495 . . . . 73.55 110.962 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -136.7 129.58 30.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 63.34 110.888 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -91.82 164.31 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.276 -0.42 . . . . 64.43 110.853 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 28.6 mtt180 -67.78 -12.47 60.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 71.15 110.889 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.23 -37.84 66.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 74.21 110.889 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -95.93 -16.84 21.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.139 -0.482 . . . . 73.23 110.904 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -153.73 79.08 5.39 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.646 0.736 . . . . 70.2 110.912 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 -6.57 18.88 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.709 2.272 . . . . 70.51 112.33 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 15.3 t -93.78 27.24 2.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 73.21 111.113 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 44.5 mt -101.31 136.79 40.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.202 -0.454 . . . . 71.54 110.985 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 10.0 t -103.17 169.99 8.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 73.45 111.103 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -49.66 -32.5 13.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.21 110.856 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -63.98 -47.64 79.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 71.24 110.875 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -65.34 -49.27 70.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 63.05 110.879 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 24.3 mm -61.54 -53.24 51.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 73.32 111.202 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 79.3 p -58.57 -23.39 58.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 73.04 110.855 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -78.79 -1.63 35.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.479 . . . . 73.44 111.062 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -114.7 10.32 16.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 74.43 110.931 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 1.7 t -97.67 -33.7 11.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.091 -1.413 . . . . 63.12 110.808 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 5.8 t 65.12 151.69 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 73.05 110.838 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.02 120.32 4.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.093 -0.503 . . . . 73.42 111.14 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -127.34 74.85 1.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 72.42 110.918 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -63.82 160.59 44.42 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.654 0.74 . . . . 74.23 110.881 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.85 113.0 3.24 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.687 2.258 . . . . 64.31 112.333 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.37 0 CA-C-O 119.132 -0.816 . . . . 64.32 112.517 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 121.417 0.454 . . . . 74.32 112.505 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -44.15 2.25 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.674 2.249 . . . . 75.43 112.366 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.3 mp -108.56 -33.33 7.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.21 -0.45 . . . . 73.23 110.94 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 169.64 -46.03 0.21 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.748 -0.739 . . . . 72.4 112.454 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 12.9 p -166.21 54.89 0.1 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.897 0.38 . . . . 61.24 110.834 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 28.0 mtt -129.4 73.61 81.5 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.57 0.7 . . . . 73.24 110.883 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.77 -7.77 21.91 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.643 2.229 . . . . 71.41 112.379 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 37.0 p-90 -100.2 -25.99 14.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.465 . . . . 72.41 110.918 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -98.73 103.14 15.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.249 -0.432 . . . . 75.24 110.913 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -79.58 -45.43 19.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 72.2 110.938 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 60.82 35.31 89.88 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.699 -0.762 . . . . 72.11 112.497 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.3 34.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.743 0.306 . . . . 73.51 110.885 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 16.7 mm -109.19 144.96 16.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 74.21 111.133 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -97.76 177.5 5.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 72.22 111.141 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ppt_? -65.35 -40.7 93.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 65.24 110.872 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -38.06 89.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 74.22 110.889 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.11 -37.7 57.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 72.44 110.93 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.61 -36.26 78.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 71.42 111.089 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -67.83 -53.06 29.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.158 -0.474 . . . . 74.32 110.913 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.09 -35.0 79.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 72.42 110.82 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.17 -36.02 82.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 74.42 110.94 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -103.19 43.44 1.08 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.18 -0.464 . . . . 71.41 110.951 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.482 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.27 -60.12 4.41 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.776 0.798 . . . . 73.42 110.914 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.482 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.74 123.32 9.99 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.627 2.218 . . . . 72.54 112.388 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.78 118.14 5.5 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.72 2.28 . . . . 75.24 112.297 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -155.01 111.08 3.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 73.01 110.884 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.16 112.69 2.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.068 -0.515 . . . . 70.34 111.154 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.97 -6.94 6.43 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.809 -0.71 . . . . 70.3 112.556 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.26 114.6 26.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.842 0.353 . . . . 75.03 110.835 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 20.2 p90 -126.24 164.34 21.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 74.33 110.927 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -161.24 136.45 7.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 75.13 110.928 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 86.2 t -110.19 132.84 57.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 73.42 111.161 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -142.3 149.96 40.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 73.33 110.846 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.22 124.05 15.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 75.12 110.911 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.8 m -60.02 112.6 1.94 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 71.13 110.857 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.9 m -68.68 -53.29 23.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 75.41 111.161 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -63.86 -29.45 70.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 75.12 110.9 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -123.45 97.4 42.45 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.648 0.737 . . . . 72.43 110.983 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.68 123.85 10.54 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.654 2.236 . . . . 73.22 112.398 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.61 -14.99 22.26 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.763 -0.732 . . . . 74.43 112.453 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -116.15 -175.34 2.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.777 0.322 . . . . 71.12 110.809 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -135.92 156.63 48.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 71.15 110.95 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 92.3 m -128.05 131.06 49.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 64.03 111.173 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.01 124.36 43.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.288 -0.415 . . . . 72.41 110.988 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.9 t -108.44 125.79 52.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 73.12 110.89 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.1 t -124.86 151.57 30.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 75.24 111.195 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -101.9 111.24 23.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 74.32 110.818 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.28 89.73 3.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 55.52 110.93 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 67.97 31.71 5.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 71.33 110.799 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.94 -14.48 62.71 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.738 -0.744 . . . . 74.32 112.515 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -88.09 139.79 30.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.839 0.352 . . . . 73.41 110.941 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 7.3 m -100.44 106.74 19.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 75.24 111.085 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -95.77 121.31 37.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 73.03 110.949 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -100.75 124.88 47.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 73.51 110.848 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -112.66 120.24 40.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.169 -0.469 . . . . 73.43 110.882 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -67.86 133.11 48.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.1 -0.5 . . . . 75.43 110.91 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 49.7 mt -117.34 107.63 22.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 73.32 111.129 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.6 ttm -83.01 123.34 29.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 74.25 110.888 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -114.07 100.8 8.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.312 -0.404 . . . . 73.11 110.949 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -136.36 142.5 43.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 75.4 110.801 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.17 35.99 25.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 75.52 111.114 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.4 t 60.33 29.76 19.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.239 -0.437 . . . . 72.1 110.811 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -136.31 140.99 43.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 74.14 110.873 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.0 mp -101.93 153.72 19.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 72.43 110.915 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.59 139.21 2.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.48 . . . . 71.21 110.863 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 50.1 mt -115.5 -28.9 2.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 71.01 111.108 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -101.14 -5.32 25.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.161 -0.472 . . . . 71.03 110.873 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 63.63 14.62 8.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.835 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -119.42 -19.74 8.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.446 . . . . 74.03 110.918 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -133.7 104.3 6.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.108 -0.497 . . . . 73.44 111.128 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -94.04 144.87 25.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.218 -0.447 . . . . 75.24 110.9 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -113.04 175.08 5.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.124 -0.489 . . . . 73.34 110.874 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -96.02 -16.91 21.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.141 -0.481 . . . . 75.35 110.861 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -173.77 158.82 3.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 62.22 110.893 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.5 -36.31 44.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 74.33 110.935 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.9 ttp -52.29 -51.39 58.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 73.5 110.902 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -66.0 -39.63 90.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 75.45 110.944 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.67 -53.41 56.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 74.32 110.907 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 69.4 t -61.5 -36.7 74.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 74.11 111.118 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -54.99 -40.27 69.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 74.03 110.903 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.21 -52.3 17.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 75.12 110.891 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -62.72 -17.15 60.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 74.34 110.94 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.3 m -87.44 -32.79 19.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.085 -0.507 . . . . 73.1 111.126 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 19.3 m -77.46 -21.56 52.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.254 -0.43 . . . . 75.13 111.182 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.74 176.35 4.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 74.32 110.832 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.88 -58.13 6.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 73.35 111.111 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.81 19.68 8.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 72.15 110.855 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 116.66 -8.45 17.14 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.742 -0.742 . . . . 72.25 112.423 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.1 mp -94.5 148.06 22.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.863 0.363 . . . . 75.23 110.869 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 22.1 p -54.35 -27.25 34.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 75.32 110.983 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 14.7 t -159.55 133.74 7.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.126 -0.488 . . . . 74.3 111.101 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.3 ptt-85 -53.93 173.14 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 72.33 110.91 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 15.0 mt -93.82 141.73 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 71.51 110.895 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 30.4 mt -125.41 -51.19 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.194 -0.457 . . . . 65.45 111.213 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -128.81 122.4 21.47 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.563 0.697 . . . . 73.31 110.886 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 138.41 37.56 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.635 2.223 . . . . 73.23 112.352 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.81 84.55 0.31 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 72.24 110.899 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.1 m -64.32 135.28 28.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 74.23 111.1 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.5 mtm . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 73.24 110.847 179.87 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 CA-C-O 121.466 0.481 . . . . 53.32 112.5 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.86 163.92 36.55 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.704 2.269 . . . . 73.41 112.335 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 36.5 mt -52.66 -32.48 42.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.26 -0.427 . . . . 75.4 110.865 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 111.44 -31.95 6.79 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.775 -0.726 . . . . 74.11 112.537 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 4.5 m -88.32 94.56 9.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.996 0.427 . . . . 64.45 110.871 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.13 140.01 18.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 73.41 110.887 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -179.87 92.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 74.34 110.895 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 5.3 t80 179.06 106.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 75.54 110.867 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 46.0 t -90.61 105.34 17.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 74.04 110.891 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -171.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.185 -0.461 . . . . 70.44 110.814 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -153.18 104.53 2.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 74.11 110.896 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -91.64 88.56 6.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 53.1 110.883 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -77.91 126.78 31.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 74.33 110.912 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -123.77 128.26 49.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.094 -0.503 . . . . 74.44 110.879 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 5.8 m -88.99 165.24 14.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 74.44 110.92 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -59.53 -19.16 46.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 74.32 110.886 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -37.01 82.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 74.13 110.887 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -104.28 -21.1 13.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 64.51 110.854 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -141.57 77.22 19.63 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.618 0.723 . . . . 74.14 110.813 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -6.76 19.37 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.732 2.288 . . . . 75.32 112.328 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 10.4 t -93.79 27.45 2.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.192 -0.458 . . . . 74.33 111.152 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 48.3 mt -100.84 136.96 39.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.192 -0.458 . . . . 75.32 110.89 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.6 t -108.84 174.35 5.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 75.13 111.183 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -50.26 -35.37 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.254 -0.43 . . . . 72.23 110.847 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -63.16 -46.88 85.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.131 -0.486 . . . . 75.13 110.935 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -68.4 -47.58 66.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.137 -0.483 . . . . 72.33 110.889 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 44.2 mm -56.03 -45.41 80.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 75.22 111.124 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 59.0 p -76.67 -15.86 59.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 70.15 110.859 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -74.92 -17.27 60.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.499 . . . . 72.35 111.066 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.5 ptp -109.8 15.17 22.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 44.45 110.875 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 13.7 t -77.7 -39.56 44.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.071 -1.422 . . . . 71.13 110.808 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.1 p 67.28 131.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 73.35 110.894 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 2.1 p -48.59 130.88 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.131 -0.486 . . . . 75.31 111.112 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -146.72 74.65 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 74.54 110.868 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.7 mttt -58.94 160.61 10.62 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.582 0.706 . . . . 74.24 110.847 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 112.06 2.98 Favored 'Trans proline' 0 C--N 1.34 0.129 0 C-N-CA 122.727 2.285 . . . . 74.12 112.37 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.684 -0.77 . . . . 61.31 112.511 -179.966 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 CA-C-O 121.414 0.452 . . . . 53.41 112.507 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 -46.33 1.23 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.63 2.22 . . . . 61.2 112.339 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.63 -30.82 8.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 71.3 110.932 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -179.57 -59.97 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.746 -0.74 . . . . 72.32 112.472 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 73.1 m -161.62 63.07 0.26 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.819 0.343 . . . . 64.53 110.837 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -134.15 73.9 68.96 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.58 0.705 . . . . 72.42 110.892 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -7.97 22.4 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.69 2.26 . . . . 73.1 112.319 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 41.5 p-90 -102.18 -26.15 13.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.23 -0.441 . . . . 74.43 110.893 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -96.01 99.7 11.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 75.13 110.857 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.8 m-70 -75.63 -36.68 60.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 65.04 110.926 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.71 27.36 58.83 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.703 -0.761 . . . . 63.42 112.52 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.46 63.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.83 0.348 . . . . 75.12 110.973 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 15.3 mm -126.76 144.0 38.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.468 . . . . 75.41 111.13 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.93 171.83 8.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.21 111.173 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.6 ppt_? -63.32 -38.24 90.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 74.42 110.839 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -76.63 -30.84 57.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 73.44 110.991 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -70.9 -43.28 68.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.099 -0.501 . . . . 74.03 110.957 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.72 -37.26 67.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 74.44 111.152 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.79 -53.1 62.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 71.42 110.906 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -33.91 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 75.25 110.841 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 9.8 mt -54.69 -38.23 66.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 74.54 110.925 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -100.33 43.5 1.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.22 -0.446 . . . . 73.21 110.92 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.489 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -64.32 -59.94 9.75 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.678 0.751 . . . . 74.45 110.941 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.4 Cg_endo -69.68 123.15 9.84 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.64 2.227 . . . . 73.24 112.394 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.67 116.56 4.61 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 122.667 2.245 . . . . 75.34 112.37 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -154.99 108.76 2.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.43 . . . . 61.21 110.901 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.61 111.93 2.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 74.22 111.15 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.66 -6.82 6.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.731 -0.747 . . . . 64.42 112.511 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 tp -89.73 111.95 23.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.836 0.351 . . . . 71.44 110.899 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.7 p90 -124.05 167.94 13.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 74.45 110.878 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -164.67 135.22 4.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.915 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.6 t -110.25 138.35 38.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.472 . . . . 72.11 111.074 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -150.66 154.32 37.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.096 -0.502 . . . . 74.32 110.851 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -51.85 124.39 12.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 74.15 110.92 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.9 m -63.84 113.39 3.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.226 -0.443 . . . . 73.13 110.861 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 m -68.9 -56.35 8.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.109 -0.496 . . . . 72.11 111.173 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -68.67 -23.86 64.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 71.01 110.942 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -115.42 94.77 40.88 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.693 0.759 . . . . 74.15 111.004 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 109.94 2.43 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.659 2.24 . . . . 73.13 112.372 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.43 3.49 24.04 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.723 -0.751 . . . . 72.24 112.536 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -129.4 -175.84 3.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.819 0.342 . . . . 71.0 110.92 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -135.93 144.87 45.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 74.21 110.948 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.7 m -108.58 141.59 40.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 75.21 111.144 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.79 107.98 16.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 75.22 110.891 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 10.5 t -93.07 134.9 34.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 64.02 110.878 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.0 t -138.07 148.35 25.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 72.33 111.126 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.51 111.64 23.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 62.41 110.905 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -113.86 91.49 3.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.142 -0.481 . . . . 71.12 110.856 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 66.38 31.55 8.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 74.24 110.913 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.98 -13.28 63.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.741 -0.742 . . . . 52.43 112.544 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -87.96 140.0 29.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.799 0.333 . . . . 74.34 110.887 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.7 t -98.77 108.15 21.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 75.42 111.13 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -101.67 128.52 47.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 74.44 110.909 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 -105.41 125.04 50.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 75.34 110.874 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -112.71 116.72 30.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.469 . . . . 63.32 110.909 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.22 137.19 44.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.125 -0.489 . . . . 74.4 110.811 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 39.8 mt -118.17 109.59 27.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 74.23 111.093 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.85 124.19 28.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 71.5 110.94 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -113.39 98.19 6.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.24 -0.436 . . . . 75.0 110.917 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -131.51 142.6 49.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.051 -0.522 . . . . 73.44 110.862 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.98 35.97 26.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.222 -0.445 . . . . 75.15 111.107 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 61.08 30.24 19.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 63.03 110.906 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -134.82 141.09 46.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.094 -0.503 . . . . 75.32 110.917 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.9 mp -102.39 149.52 24.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.442 . . . . 75.02 110.892 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 14.0 t -166.9 137.8 3.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 73.01 110.861 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 53.2 mt -115.7 -32.16 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.51 . . . . 74.34 111.16 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.422 ' O ' ' CG ' ' A' ' 142' ' ' GLU . 49.3 t0 -97.39 10.6 39.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 71.23 110.89 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 9.7 pt-20 45.96 29.89 0.82 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.157 -0.474 . . . . 71.41 110.888 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -132.51 -40.08 1.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 73.42 110.867 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.7 p -116.28 104.62 16.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 73.24 111.11 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -93.41 150.75 20.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 72.31 110.952 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -121.08 178.2 4.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.193 -0.458 . . . . 75.24 110.896 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -100.37 -16.08 17.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 75.25 110.891 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -164.88 172.5 12.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 72.21 110.853 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.6 -27.55 60.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 72.34 110.893 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.7 -57.21 14.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 71.14 110.85 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -66.04 -36.36 83.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 73.11 110.951 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.63 -49.52 72.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.926 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 71.3 t -63.42 -38.36 81.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 75.41 111.121 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.99 -39.35 68.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 73.14 110.844 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -71.42 -44.55 64.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 74.24 110.817 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -68.26 -20.81 64.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 64.24 110.925 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 67.2 m -84.66 -30.39 24.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 72.15 111.161 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 13.2 m -79.68 -25.12 41.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.268 -0.424 . . . . 75.44 111.123 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -162.27 155.48 20.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 74.51 110.898 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.35 -58.4 6.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 73.4 111.089 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 51.77 29.81 6.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 73.54 110.876 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 120.57 -14.7 9.92 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.735 -0.745 . . . . 62.14 112.462 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -88.13 136.9 32.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.915 0.388 . . . . 74.34 110.939 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 19.3 p -53.86 -26.46 24.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 53.31 110.851 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 10.2 t -157.58 127.55 6.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 72.04 111.151 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -54.98 140.44 37.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 75.35 110.841 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 8.1 mt -60.31 141.44 56.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.464 . . . . 71.44 110.901 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 24.2 mt -126.97 -51.41 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 64.43 111.081 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -131.68 124.27 19.8 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.538 0.685 . . . . 75.0 110.922 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.89 136.65 33.17 Favored 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.664 2.243 . . . . 73.52 112.296 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.73 85.0 0.31 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 72.31 110.89 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 25.2 m -64.12 133.17 29.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 73.32 111.118 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 28.4 mtp . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 75.54 110.911 179.921 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 CA-C-O 121.429 0.461 . . . . 74.55 112.485 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 165.91 29.34 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.627 2.218 . . . . 72.23 112.384 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 3.2 mp -58.42 -33.95 70.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.184 -0.462 . . . . 73.13 110.974 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 92.03 30.71 9.89 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.768 -0.73 . . . . 72.23 112.482 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 75.2 m -78.69 156.03 29.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.952 0.406 . . . . 75.22 110.938 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -101.32 161.08 13.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 74.31 110.94 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -172.71 163.55 5.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.419 . . . . 74.35 110.859 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -167.76 62.8 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 74.35 110.814 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 18.6 p -179.41 139.76 0.15 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.155 -0.475 . . . . 65.34 110.833 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 2.2 t -178.63 105.36 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 75.13 110.922 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -163.85 100.57 0.89 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 73.44 110.934 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.83 88.82 6.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 74.14 110.86 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -77.82 147.52 35.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 72.13 111.006 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.19 129.23 19.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 72.24 110.859 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.27 160.12 14.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 74.14 110.817 -179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 -61.82 -17.26 55.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 75.02 110.953 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -37.13 84.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 73.42 110.909 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -97.99 -19.17 18.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 65.11 110.915 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -150.98 80.08 6.74 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.608 0.718 . . . . 75.3 110.872 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 -6.58 18.94 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.652 2.234 . . . . 72.25 112.348 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.7 t -94.06 27.45 2.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 73.33 111.049 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 46.2 mt -100.81 136.84 40.03 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.267 -0.424 . . . . 75.11 110.959 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 10.8 t -105.56 171.0 7.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 73.24 111.093 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -49.57 -35.42 20.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 72.34 110.848 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -61.38 -47.78 84.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.152 -0.476 . . . . 72.42 110.903 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -67.97 -52.08 39.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 74.32 110.84 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 40.2 mm -56.65 -53.52 40.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 72.21 111.183 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 84.1 p -57.28 -29.85 64.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 65.33 110.789 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -69.91 -10.25 57.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 72.45 111.101 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -105.5 7.73 33.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 64.43 110.854 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 24.3 p -95.49 -33.22 12.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.174 -1.375 . . . . 75.44 110.873 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.11 151.61 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 71.43 110.884 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 5.7 m -55.89 122.89 5.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.17 -0.468 . . . . 75.51 111.143 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -131.34 74.63 1.6 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 60.11 110.846 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? -64.55 160.38 52.64 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.546 0.688 . . . . 75.14 110.886 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 111.3 2.76 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.646 2.231 . . . . 64.32 112.382 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 CA-C-O 119.093 -0.837 . . . . 64.44 112.485 -179.992 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 CA-C-O 121.415 0.453 . . . . 65.15 112.456 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -43.42 2.64 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.713 2.275 . . . . 61.31 112.316 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -107.31 -29.29 9.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.198 -0.455 . . . . 73.04 110.898 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 158.64 -58.86 0.33 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.749 -0.738 . . . . 42.43 112.491 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.2 t -159.29 43.2 0.23 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.856 0.36 . . . . 74.1 110.926 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -133.83 70.26 75.16 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.581 0.705 . . . . 74.53 110.882 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.76 -30.34 22.46 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.741 2.294 . . . . 73.22 112.382 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 50.1 p-90 -54.76 -26.67 35.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 75.13 110.893 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -88.0 100.65 13.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.295 -0.411 . . . . 74.13 110.888 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -75.68 -38.39 58.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.488 . . . . 73.14 110.883 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.68 18.84 40.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.799 -0.715 . . . . 73.12 112.473 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.72 81.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.775 0.322 . . . . 75.42 110.884 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 29.3 mm -147.1 145.16 19.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.245 -0.434 . . . . 74.42 111.145 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -97.82 177.29 5.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 73.03 111.132 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -38.86 89.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 73.22 110.905 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -37.68 88.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.246 -0.434 . . . . 72.54 110.973 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -37.06 57.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.077 -0.511 . . . . 74.35 110.966 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.37 -33.79 65.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 71.13 111.132 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -67.74 -53.09 30.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 74.14 110.923 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.16 -39.26 94.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 74.22 110.853 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.1 mt -58.97 -37.57 77.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 75.11 110.942 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -100.88 43.07 1.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.442 . . . . 75.42 110.902 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.483 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -70.01 -59.92 3.98 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.668 0.747 . . . . 74.23 110.924 -179.978 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.0 Cg_endo -69.74 124.05 10.71 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.771 2.314 . . . . 75.22 112.309 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 117.32 5.01 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.648 2.232 . . . . 74.42 112.407 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -155.09 102.6 2.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 74.42 110.884 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.03 111.51 0.96 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 72.0 111.142 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 131.28 -10.5 5.59 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.755 -0.736 . . . . 60.52 112.47 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -86.71 111.64 20.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.823 0.344 . . . . 73.31 110.933 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 21.0 p90 -124.2 162.38 23.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 70.45 110.888 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -159.11 135.76 9.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 75.1 110.931 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 93.1 t -109.9 134.71 51.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.221 -0.445 . . . . 75.25 111.078 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 7.5 ptt85 -148.27 141.67 25.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.451 . . . . 74.54 110.941 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -51.29 128.65 22.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 64.25 110.906 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.23 116.87 3.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 74.31 110.861 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 9.8 m -70.23 -26.28 63.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 75.15 111.121 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -106.68 -0.91 23.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.2 -0.455 . . . . 71.4 110.946 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -139.95 90.41 10.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.641 0.734 . . . . 70.31 110.969 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 118.34 5.62 Favored 'Trans proline' 0 C--N 1.34 0.131 0 C-N-CA 122.648 2.232 . . . . 74.2 112.345 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 114.19 -14.68 21.03 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.777 -0.725 . . . . 65.21 112.533 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -120.14 158.84 26.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.783 0.325 . . . . 74.31 110.911 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -113.86 149.32 35.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 72.34 110.886 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.5 m -125.48 124.51 41.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 65.41 111.125 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.38 134.39 39.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 75.1 110.957 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 48.8 t -116.94 127.06 53.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.455 . . . . 75.02 110.934 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.7 t -123.68 152.82 29.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.46 . . . . 74.14 111.097 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -104.39 112.13 25.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 54.52 110.883 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.76 95.7 5.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 73.43 110.915 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 67.68 28.55 7.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.465 . . . . 75.44 110.938 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.74 -14.39 63.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.746 -0.74 . . . . 65.24 112.51 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 142.45 27.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.37 . . . . 72.35 110.897 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 12.1 m -100.57 114.28 38.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.476 . . . . 72.54 111.185 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -104.69 123.79 48.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 72.02 110.855 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -100.52 129.17 46.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.484 . . . . 73.13 110.873 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -117.94 104.01 10.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.186 -0.461 . . . . 64.32 110.901 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.02 140.18 52.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 74.14 110.905 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 44.2 mt -124.97 109.39 22.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 71.44 111.083 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.65 131.7 36.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 73.33 110.832 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -117.62 102.4 9.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.24 -0.436 . . . . 73.54 110.898 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -138.76 142.59 38.8 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 75.31 110.833 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 59.06 35.96 24.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 73.24 111.117 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 59.88 31.14 20.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.431 . . . . 64.33 110.835 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -137.8 143.16 40.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.468 . . . . 74.43 110.954 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mp -105.57 152.18 23.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 72.13 110.946 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 43.9 t -169.91 141.65 2.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 61.32 110.837 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 44.5 mt -113.31 -36.39 2.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 74.33 111.175 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 9.0 p30 -87.9 -1.57 58.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 62.21 110.886 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 61.07 17.38 7.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 74.04 110.812 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -126.19 -32.29 2.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 74.11 110.902 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -114.03 104.85 17.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.491 . . . . 74.14 111.068 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -97.63 144.35 27.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 64.52 110.886 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -117.72 171.58 7.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 73.44 110.892 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.23 -15.45 31.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 72.1 110.914 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -175.27 158.65 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 75.3 110.919 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -51.43 -36.73 45.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.467 . . . . 74.44 110.897 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.1 ttt -51.84 -50.17 61.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 72.32 110.956 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -67.89 -41.6 82.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 73.42 110.925 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -47.38 77.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 71.15 110.918 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 89.7 t -63.77 -38.03 81.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 74.33 111.074 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -57.86 -38.33 75.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.137 -0.483 . . . . 74.31 110.852 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.81 -48.16 48.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 64.45 110.858 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -67.02 -20.12 65.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 71.21 110.95 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 77.9 m -84.91 -30.07 24.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 64.41 111.167 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 72.3 m -79.69 -25.01 41.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.147 -0.479 . . . . 75.34 111.193 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.68 167.35 25.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 71.44 110.836 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.11 -57.88 7.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 64.45 111.109 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.09 17.45 9.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 63.43 110.882 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.55 15.92 9.89 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.756 -0.735 . . . . 73.33 112.451 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.8 mp -112.19 137.64 50.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.894 0.378 . . . . 75.51 110.935 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 23.7 t -51.51 -30.13 19.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.178 -0.465 . . . . 73.01 110.89 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.6 t -151.45 120.47 6.68 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.176 -0.466 . . . . 73.24 111.101 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.09 151.81 4.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 75.24 110.897 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 6.4 mt -67.56 133.85 50.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.184 -0.462 . . . . 72.42 110.878 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 24.7 mt -127.03 -51.32 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 74.51 111.129 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -126.66 120.29 23.04 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.602 0.715 . . . . 75.23 110.911 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 135.08 29.52 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.677 2.251 . . . . 75.35 112.273 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.02 84.75 0.34 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 75.25 110.879 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 19.1 t -64.38 140.58 19.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 74.5 111.143 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 3.8 ptt? . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 74.5 110.882 179.968 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 CA-C-O 121.42 0.456 . . . . 73.14 112.512 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 161.53 45.58 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.721 2.281 . . . . 75.4 112.302 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 33.0 tp -53.32 -36.61 61.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 73.33 110.947 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 110.7 -20.25 24.97 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.756 -0.735 . . . . 72.34 112.443 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.93 144.04 27.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.903 0.383 . . . . 71.24 110.904 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -143.3 155.92 44.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.14 -0.482 . . . . 74.33 110.967 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -177.88 155.62 1.01 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.436 . . . . 73.03 110.835 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -157.14 78.34 0.89 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 75.23 110.903 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 13.1 p -174.76 89.58 0.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 74.43 110.844 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -159.27 114.42 2.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 53.34 110.817 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -164.02 115.17 1.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 71.2 110.883 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.21 88.14 2.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.207 -0.451 . . . . 74.24 110.853 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -85.26 149.16 25.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.501 . . . . 73.13 110.888 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.32 128.69 16.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.14 -0.482 . . . . 74.33 110.93 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.39 158.71 18.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 73.2 110.862 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 28.2 mtt180 -58.12 -20.27 39.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.04 110.895 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -36.5 81.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 75.32 110.884 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -99.32 -24.69 14.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.463 . . . . 73.01 110.926 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -143.69 79.16 13.81 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.663 0.744 . . . . 73.05 110.828 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 -5.69 16.78 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.661 2.241 . . . . 72.34 112.394 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.7 t -92.48 27.44 2.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 71.31 111.205 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 22.8 mt -102.9 136.71 42.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.462 . . . . 63.22 110.925 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.7 t -105.65 173.49 6.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 71.15 111.172 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -49.9 -37.4 31.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 73.04 110.84 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 34.6 tp10 -60.92 -52.14 66.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 65.51 110.932 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -65.11 -51.94 58.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.07 -0.513 . . . . 74.32 110.916 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 45.5 mm -55.88 -54.35 27.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 64.52 111.122 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 50.6 m -62.85 -18.48 62.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 43.25 110.876 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -80.16 1.18 29.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 74.32 111.091 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 4.1 mtm -115.44 14.35 16.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.441 . . . . 73.21 110.957 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 38.1 t -111.42 -34.37 6.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.144 -1.389 . . . . 75.44 110.828 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 65.21 149.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 72.1 110.841 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 13.5 m -62.17 125.99 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 72.43 111.172 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -140.39 82.89 1.88 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 62.54 110.879 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.56 160.47 5.39 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.575 0.702 . . . . 72.31 110.912 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 113.52 3.41 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.727 2.285 . . . . 70.13 112.325 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 CA-C-O 119.142 -0.81 . . . . 51.51 112.537 179.967 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 CA-C-O 121.495 0.497 . . . . 72.33 112.472 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 -171.8 0.51 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.64 2.227 . . . . 74.2 112.382 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.9 mp -57.44 -48.05 80.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 71.23 110.947 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 169.37 -36.01 0.19 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.722 -0.751 . . . . 62.04 112.46 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 8.0 m -134.72 57.61 1.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.832 0.349 . . . . 72.34 110.789 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 mtp -129.97 73.83 81.07 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.6 0.714 . . . . 75.4 110.921 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 -7.82 22.02 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.729 2.286 . . . . 72.53 112.381 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 41.1 p-90 -102.28 -30.39 11.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.23 110.908 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -84.93 101.1 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 74.33 110.819 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.84 -37.5 58.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 75.11 110.848 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.55 18.62 38.28 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.774 -0.727 . . . . 54.43 112.52 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.92 80.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.812 0.339 . . . . 72.01 110.93 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 16.7 mm -141.42 144.29 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 75.21 111.085 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 m -98.7 160.42 14.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.15 -0.477 . . . . 71.24 111.168 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.83 -41.05 61.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.243 -0.435 . . . . 73.21 110.827 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -69.67 -36.0 75.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.257 -0.429 . . . . 74.51 110.902 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -70.28 -41.92 72.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 71.14 110.824 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.93 -33.85 59.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 75.13 111.1 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -58.81 -52.29 66.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 74.14 110.838 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.68 -37.36 79.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 64.05 110.866 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.3 mt -55.04 -38.29 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 72.22 110.94 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -100.32 43.61 1.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.447 . . . . 72.12 110.867 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.479 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.48 -60.13 5.13 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.68 0.752 . . . . 74.34 110.929 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.0 Cg_endo -69.76 123.43 10.09 Favored 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.696 2.264 . . . . 74.1 112.311 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.85 117.89 5.36 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.693 2.262 . . . . 72.03 112.308 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.82 104.95 2.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 75.21 110.864 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.0 p -57.99 111.95 1.34 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.095 -0.502 . . . . 51.43 111.132 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.52 -6.24 6.25 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.744 -0.741 . . . . 44.01 112.55 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.73 112.62 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 74.13 110.913 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -123.96 166.55 15.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 73.53 110.915 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -162.0 136.53 6.9 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 72.12 110.903 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 86.1 t -110.05 140.35 29.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 72.54 111.101 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -153.63 146.58 24.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 72.41 110.866 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -50.79 123.92 10.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.16 -0.473 . . . . 75.25 110.899 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.4 m -59.67 113.48 2.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 75.11 110.848 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.2 m -68.55 -55.87 10.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 70.44 111.143 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -63.67 -29.26 70.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 74.24 110.934 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.405 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 1.2 m-85 -119.38 97.69 50.26 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.691 0.758 . . . . 72.33 110.884 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.6 Cg_endo -69.72 117.68 5.22 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.677 2.252 . . . . 73.34 112.347 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.61 -2.78 24.75 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.74 -0.743 . . . . 54.44 112.482 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -122.75 -176.33 3.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.866 0.365 . . . . 64.21 110.808 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -135.24 142.53 46.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 73.54 110.869 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.5 m -109.64 137.79 46.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.127 -0.488 . . . . 70.03 111.166 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.84 114.68 28.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 63.2 110.932 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.2 t -100.82 129.95 46.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 74.34 110.844 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.9 t -131.29 150.43 34.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 75.33 111.101 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.92 111.44 23.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.466 . . . . 75.2 110.828 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.02 92.38 3.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.088 -0.506 . . . . 71.23 110.876 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 66.61 30.8 8.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 74.1 110.926 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 98.25 -13.64 62.99 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.727 -0.749 . . . . 73.3 112.535 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.78 140.02 29.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.855 0.359 . . . . 74.11 110.939 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 6.7 m -101.3 105.53 17.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.266 -0.424 . . . . 63.41 111.082 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -97.11 129.67 44.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 75.03 110.855 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -106.66 124.3 49.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 73.11 110.845 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -111.96 102.98 11.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.261 -0.427 . . . . 74.01 110.95 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -59.68 140.09 56.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 71.2 110.859 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 42.2 mt -120.45 109.01 24.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.468 . . . . 74.4 111.147 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.38 130.45 40.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 75.11 110.884 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -116.74 113.51 22.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.232 -0.44 . . . . 75.03 110.886 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -146.26 136.89 24.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 74.4 110.829 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.15 35.85 23.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 75.1 111.043 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.32 30.53 15.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.269 -0.423 . . . . 62.31 110.829 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -130.6 138.28 50.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 75.51 110.933 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mp -101.16 150.47 22.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 74.43 110.915 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -168.38 134.97 1.96 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.827 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 51.8 mt -113.32 -40.66 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 72.22 111.107 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 15.9 p30 -84.49 -5.64 59.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 64.21 110.919 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 61.57 16.29 7.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.11 110.853 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -125.36 -8.15 6.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 73.44 110.897 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 6.0 t -144.35 104.5 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 72.21 111.102 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -94.76 146.77 23.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.148 -0.478 . . . . 73.34 110.902 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -117.33 176.15 5.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 63.44 110.911 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -100.44 -14.56 18.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 73.12 110.861 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -167.05 171.87 10.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 74.34 110.918 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.49 -22.72 58.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.15 -0.477 . . . . 72.03 110.907 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.2 ttt -61.58 -56.76 16.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 60.12 110.912 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -67.18 -36.3 81.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 70.33 110.943 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.26 -53.15 59.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 73.32 110.931 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 65.3 t -62.2 -36.74 76.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 61.25 111.14 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -54.78 -39.76 68.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.069 -0.514 . . . . 74.23 110.933 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -71.75 -49.01 42.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.13 -0.486 . . . . 73.24 110.838 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -62.92 -23.67 67.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.233 -0.44 . . . . 71.34 110.939 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.1 m -83.96 -29.47 27.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.082 -0.508 . . . . 65.21 111.155 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 42.3 m -77.65 -23.52 49.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 71.11 111.164 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -165.24 160.17 18.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.205 -0.452 . . . . 71.44 110.857 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.91 -58.12 6.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 72.34 111.157 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 21.5 t70 55.87 25.11 8.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 71.22 110.834 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 118.73 -10.86 12.29 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.792 -0.718 . . . . 53.23 112.441 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 10.8 mp -87.21 138.66 31.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.87 0.367 . . . . 74.34 110.85 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 18.4 p -54.6 -26.31 31.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 71.13 110.936 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 9.2 t -157.54 124.98 5.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.133 -0.485 . . . . 74.51 111.128 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -52.66 147.9 7.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 75.34 110.815 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.5 mt -65.93 138.83 58.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.1 -0.5 . . . . 75.31 110.915 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 24.9 mt -127.16 -51.29 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 75.21 111.094 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -129.93 122.25 20.3 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.531 0.681 . . . . 74.23 110.873 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.86 138.95 38.69 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.689 2.259 . . . . 73.53 112.287 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 84.13 0.42 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 74.42 110.85 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 15.2 m -64.37 130.75 29.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 53.43 111.12 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 75.15 110.845 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 CA-C-O 121.5 0.5 . . . . 72.12 112.431 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.87 169.99 17.75 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.713 2.275 . . . . 75.11 112.346 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 5.5 mp -52.6 -49.83 64.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 63.53 110.912 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 103.38 -40.89 2.28 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.762 -0.733 . . . . 72.12 112.503 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 13.0 t -103.53 131.93 50.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.934 0.397 . . . . 75.04 110.859 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.01 173.99 15.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 74.04 110.912 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.66 111.59 2.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 74.21 110.937 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -176.74 111.43 0.09 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 72.32 110.91 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 3.3 t -89.23 89.29 7.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.111 -0.495 . . . . 74.41 110.802 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 99.2 p -60.91 -172.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.495 . . . . 61.04 110.898 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -163.83 105.48 0.93 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.142 -0.481 . . . . 73.41 110.876 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.4 m -100.47 88.74 3.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 72.31 110.894 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -83.53 147.27 27.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 73.32 110.97 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.1 128.82 21.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.114 -0.493 . . . . 73.35 110.937 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.87 156.09 19.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 73.55 110.893 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -60.85 -18.0 53.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.853 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.2 -39.05 86.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 74.43 110.848 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -92.5 -20.49 20.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.878 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -148.84 81.36 7.71 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.674 0.749 . . . . 74.45 110.902 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -6.84 19.53 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.711 2.274 . . . . 74.44 112.374 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.3 t -94.13 27.3 2.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.205 -0.452 . . . . 74.11 111.097 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 62.2 mt -100.4 136.7 39.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.264 -0.425 . . . . 74.01 110.914 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 7.2 t -93.82 152.99 18.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.454 . . . . 74.52 111.142 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -49.1 -31.83 8.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 65.23 110.9 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.77 -54.97 40.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 71.54 110.881 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' B' ' 310' ' ' ILE . 0.3 OUTLIER -57.15 -32.41 66.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 73.51 110.935 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . 0.419 ' N ' ' HG3' ' B' ' 309' ' ' GLU . 27.0 mm -63.31 -53.2 48.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 74.55 111.099 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.33 -21.26 63.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 73.31 110.868 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -76.88 -3.13 37.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.499 . . . . 62.04 111.139 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 2.6 mtm -111.82 6.39 19.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.822 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 43.9 t -73.15 -30.6 63.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.113 -1.403 . . . . 40.3 110.812 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 65.94 145.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 71.41 110.86 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 6.7 m -56.63 116.29 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 64.52 111.139 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -125.21 74.89 1.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 75.35 110.88 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 13.3 mtmt -54.65 160.48 2.74 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.652 0.739 . . . . 74.51 110.919 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.69 113.45 3.37 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.619 2.212 . . . . 70.3 112.409 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 CA-C-O 119.062 -0.855 . . . . 45.14 112.462 -179.993 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 CA-C-O 121.422 0.457 . . . . 72.24 112.471 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 -41.44 4.35 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.656 2.237 . . . . 73.32 112.422 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -155.44 33.34 0.37 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.136 -0.483 . . . . 63.54 110.849 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 156.35 -104.73 0.26 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.805 -0.712 . . . . 63.32 112.54 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 7.0 m -149.06 64.5 1.04 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.856 0.36 . . . . 72.11 110.855 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 37.0 mtm -135.35 74.06 61.95 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.586 0.708 . . . . 72.35 110.894 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 -7.71 21.75 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.748 2.299 . . . . 75.25 112.323 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 34.2 p-90 -101.51 -30.9 11.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 73.24 110.908 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -87.32 99.48 12.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 75.12 110.851 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -75.71 -33.64 60.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 74.13 110.909 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.95 19.59 37.93 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.738 -0.744 . . . . 74.13 112.449 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.08 82.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.77 0.319 . . . . 75.51 110.919 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 29.5 mm -146.8 145.04 19.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 72.23 111.158 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.2 p -101.14 177.34 4.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 71.31 111.096 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -41.08 97.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 72.01 110.82 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -62.91 -38.26 90.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 72.54 110.938 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -36.23 60.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.105 -0.498 . . . . 63.03 110.962 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.41 -33.83 67.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 75.33 111.101 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -68.69 -53.14 24.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 64.24 110.878 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.17 -40.03 96.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 71.14 110.856 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.9 mt -58.63 -38.2 77.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 73.42 110.911 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -101.42 43.36 1.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 75.42 110.852 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.481 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.29 -60.13 4.39 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.68 0.752 . . . . 72.35 110.902 179.924 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.4 Cg_endo -69.72 124.08 10.75 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.615 2.21 . . . . 73.44 112.445 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 116.92 4.78 Favored 'Trans proline' 0 C--O 1.23 0.124 0 C-N-CA 122.704 2.269 . . . . 62.1 112.325 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -154.79 110.58 3.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 74.23 110.863 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.1 p -62.71 111.8 2.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 65.32 111.114 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.76 -7.07 6.17 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.74 -0.743 . . . . 72.12 112.443 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 3.0 tp -89.51 111.59 22.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 73.54 110.969 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -123.31 167.7 13.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.213 -0.449 . . . . 74.42 110.885 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.45 134.02 5.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 65.12 110.873 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.2 t -110.03 140.04 30.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 74.51 111.067 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.5 151.65 29.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 75.33 110.884 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -51.38 124.24 11.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 73.53 110.904 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.6 m -59.17 112.05 1.57 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 53.1 110.86 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.3 m -68.77 -56.46 7.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 65.45 111.126 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -67.26 -24.99 65.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 71.11 110.915 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -116.42 95.43 45.51 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.69 0.757 . . . . 75.45 110.896 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 110.52 2.58 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.66 2.24 . . . . 63.24 112.353 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.7 6.31 21.41 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.707 -0.759 . . . . 71.02 112.461 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -132.44 -177.81 4.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.797 0.332 . . . . 73.54 110.841 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -129.01 155.83 44.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 73.53 110.88 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.9 m -125.84 139.94 53.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.07 -0.514 . . . . 75.14 111.123 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.71 115.01 26.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.197 -0.456 . . . . 75.14 110.931 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.6 t -100.83 126.97 47.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.42 110.889 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.4 t -127.81 153.28 36.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 74.41 111.127 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -104.24 111.76 24.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.461 . . . . 72.03 110.823 -179.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.47 92.37 3.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 74.42 110.844 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 66.95 31.25 7.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 65.02 110.89 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.71 -14.48 62.99 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.739 -0.743 . . . . 74.11 112.511 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -87.56 143.38 27.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.796 0.331 . . . . 75.24 110.916 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 9.9 m -103.8 112.97 39.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 71.41 111.12 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.5 pm0 -105.54 126.56 52.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 70.41 110.913 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -103.33 126.46 50.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.171 -0.468 . . . . 73.54 110.854 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -110.49 116.17 30.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 72.1 110.87 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.04 136.92 50.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.102 -0.499 . . . . 75.23 110.885 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 81.2 mt -118.61 109.28 26.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 74.42 111.101 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.11 130.41 39.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 73.42 110.853 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -114.09 116.67 29.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.878 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -150.35 136.07 18.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 72.32 110.852 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.11 35.93 23.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.198 -0.456 . . . . 60.13 111.108 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.71 29.98 14.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 71.45 110.889 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -129.29 142.24 50.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 72.13 110.887 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.1 mp -106.09 148.62 27.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 71.53 110.966 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.2 t -166.95 131.29 1.97 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.226 -0.443 . . . . 74.53 110.899 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 41.0 mt -107.48 -32.25 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 74.23 111.13 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.6 t0 -86.59 -1.17 57.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 71.3 110.845 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 60.64 17.85 7.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 60.02 110.849 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -132.46 -38.43 1.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 71.44 110.961 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.0 t -104.49 104.55 17.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.075 -0.511 . . . . 74.22 111.109 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -98.78 146.02 26.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.18 -0.463 . . . . 75.2 110.95 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -116.71 178.25 4.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 73.15 110.895 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.5 -15.87 17.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.173 -0.467 . . . . 74.2 110.905 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -165.81 171.89 12.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 74.21 110.869 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.05 -22.8 58.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 73.34 110.909 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -56.76 13.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 74.25 110.875 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -65.86 -35.2 79.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 72.31 110.913 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.35 -52.69 62.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 71.41 110.975 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 75.0 t -62.67 -36.61 76.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 73.13 111.126 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -55.02 -39.29 68.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.117 -0.492 . . . . 74.34 110.887 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.97 -45.99 58.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 74.34 110.887 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -65.63 -23.68 66.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 70.41 110.99 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 87.3 m -84.14 -28.94 27.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 74.41 111.131 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 29.1 m -77.67 -26.21 50.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 72.43 111.163 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -165.03 162.85 20.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 71.34 110.892 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.99 -58.4 6.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 65.12 111.126 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 32.0 t70 57.93 21.69 7.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 75.43 110.876 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.27 7.33 21.11 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.803 -0.713 . . . . 63.42 112.518 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 7.8 mp -100.66 138.92 37.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.787 0.327 . . . . 74.52 110.959 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 36.1 t -51.35 -30.8 19.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 43.04 110.889 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 9.5 t -158.47 126.17 5.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 75.32 111.184 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -51.69 152.41 2.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 71.43 110.823 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 9.9 mt -74.33 139.04 43.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 63.02 110.847 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 26.1 mt -127.14 -51.18 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 65.11 111.124 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -130.19 119.44 18.69 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.596 0.712 . . . . 73.43 110.831 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 140.76 43.39 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.716 2.277 . . . . 72.32 112.287 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.65 83.76 0.44 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.163 -0.472 . . . . 71.2 110.899 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 30.2 m -64.45 126.28 22.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 74.31 111.154 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.4 mtm . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 72.35 110.894 179.949 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 CA-C-O 121.438 0.466 . . . . 75.23 112.46 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 168.9 20.23 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.674 2.249 . . . . 72.13 112.341 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.07 -35.45 66.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.23 -0.441 . . . . 72.33 110.85 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 96.92 29.16 8.24 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.802 -0.713 . . . . 74.4 112.511 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 63.0 p -82.3 141.9 32.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.873 0.368 . . . . 72.41 110.949 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -78.18 105.17 9.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 73.13 110.891 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -179.38 124.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 74.33 110.879 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -114.05 -176.42 2.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.448 . . . . 75.14 110.905 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 3.0 p 178.79 93.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.109 -0.496 . . . . 71.25 110.898 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -168.06 97.16 0.44 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 64.1 110.774 -179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -164.41 88.57 0.5 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.474 . . . . 72.22 110.895 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.74 91.07 8.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 72.3 110.865 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -79.85 149.59 30.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 73.43 110.907 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -144.34 129.18 18.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.067 -0.515 . . . . 72.33 110.944 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.89 158.37 15.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 74.51 110.905 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -62.75 -16.64 58.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.181 -0.463 . . . . 75.05 110.871 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -39.28 90.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 71.25 110.852 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -90.61 -25.38 20.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 64.13 110.812 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -147.03 84.97 7.14 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.627 0.727 . . . . 72.54 110.882 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.76 -6.6 19.0 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.699 2.266 . . . . 75.15 112.367 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.2 t -94.39 27.36 2.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 74.22 111.149 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 57.3 mt -101.11 136.83 40.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 72.22 110.879 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 10.1 t -92.02 152.89 19.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 73.25 111.116 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -49.89 -31.2 11.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 75.54 110.895 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -54.07 50.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 74.41 110.865 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . 0.412 ' HG3' ' N ' ' B' ' 310' ' ' ILE . 0.3 OUTLIER -58.92 -32.45 69.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 74.33 110.91 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . 0.412 ' N ' ' HG3' ' B' ' 309' ' ' GLU . 30.5 mm -62.08 -53.67 44.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.152 -0.476 . . . . 71.24 111.076 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 1.1 p -56.9 -30.78 64.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 71.43 110.926 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -64.39 -15.14 59.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.513 . . . . 64.44 111.108 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.6 mtm -104.94 8.0 34.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 74.2 110.925 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -96.35 -35.57 11.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.102 -1.408 . . . . 74.45 110.829 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.3 156.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 72.34 110.837 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 5.7 m -51.41 130.09 11.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.06 -0.518 . . . . 72.31 111.138 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -145.76 75.01 1.41 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.192 -0.458 . . . . 72.43 110.891 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.08 160.14 1.28 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.593 0.711 . . . . 73.42 110.879 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 111.59 2.86 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.694 2.263 . . . . 63.23 112.352 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 CA-C-O 119.158 -0.801 . . . . 72.25 112.502 -179.994 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 CA-C-O 121.41 0.45 . . . . 74.22 112.484 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 -8.18 22.96 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.68 2.253 . . . . 73.12 112.324 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 63.81 23.04 13.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 73.45 110.884 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.1 -67.19 1.95 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.694 -0.765 . . . . 71.24 112.5 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 7.7 p -142.48 30.27 1.54 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.895 0.378 . . . . 71.54 110.912 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.82 75.62 9.95 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.588 0.708 . . . . 71.43 110.822 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.74 -25.55 28.58 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.661 2.241 . . . . 63.42 112.406 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 47.6 p-90 -54.83 -25.75 30.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 71.34 110.919 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -90.66 99.26 12.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 75.22 110.899 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -75.96 -41.99 49.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.106 -0.497 . . . . 75.11 110.906 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.54 25.39 55.17 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.731 -0.747 . . . . 72.03 112.541 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.4 65.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 74.0 110.875 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.8 mm -136.06 145.25 31.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 74.2 111.084 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.9 p -97.48 177.09 5.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 74.21 111.15 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -65.98 -39.46 90.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 74.2 110.822 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.92 -37.63 88.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.261 -0.427 . . . . 71.32 110.897 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.01 -37.83 58.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.506 . . . . 73.53 110.904 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.57 -33.98 67.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 65.2 111.118 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -67.14 -53.14 33.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 72.03 110.886 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -40.06 94.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 75.01 110.896 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.6 mt -56.41 -38.85 72.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 73.22 110.95 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -99.48 43.26 1.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 64.44 110.902 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.483 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.11 -60.04 4.62 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.717 0.77 . . . . 72.43 110.891 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.5 Cg_endo -69.79 123.99 10.63 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.728 2.286 . . . . 64.35 112.315 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.65 117.69 5.23 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.706 2.27 . . . . 74.23 112.38 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -155.12 103.67 2.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 74.25 110.841 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -57.33 111.83 1.21 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 72.53 111.116 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.34 -8.92 5.93 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.761 -0.733 . . . . 42.2 112.523 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.6 tp -88.07 111.89 22.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.891 0.377 . . . . 71.21 110.875 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 25.7 p90 -123.54 165.31 17.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 74.43 110.888 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -161.58 137.34 7.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.478 . . . . 71.41 110.883 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 91.1 t -109.52 129.91 63.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.221 -0.445 . . . . 72.55 111.15 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.91 137.93 29.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 71.04 110.946 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.4 126.96 18.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.45 . . . . 73.15 110.935 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.0 m -55.57 114.01 1.68 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.794 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 m -70.07 -49.16 53.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.135 -0.484 . . . . 64.34 111.098 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -80.16 -3.17 47.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 72.31 110.932 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -139.48 88.6 12.52 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.615 0.721 . . . . 72.13 110.897 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 122.29 8.98 Favored 'Trans proline' 0 C--N 1.34 0.117 0 C-N-CA 122.679 2.252 . . . . 71.24 112.341 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.87 -8.21 23.62 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.714 -0.755 . . . . 73.45 112.567 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -127.94 -179.64 5.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.759 0.314 . . . . 65.3 110.9 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -130.86 164.33 25.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 73.24 110.94 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 97.3 m -143.87 128.16 17.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 74.25 111.138 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.31 132.75 42.74 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.272 -0.422 . . . . 74.13 110.917 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 5.8 m -113.02 126.54 55.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.166 -0.47 . . . . 74.44 110.908 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.3 t -126.61 152.37 34.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 74.11 111.116 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -104.66 111.9 24.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 73.12 110.87 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -115.26 93.04 4.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 53.11 110.911 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 66.68 31.03 7.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 73.32 110.887 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.31 -12.87 65.0 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.79 -0.719 . . . . 53.11 112.491 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.18 139.91 30.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.805 0.336 . . . . 73.52 110.906 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 92.6 t -99.93 111.21 28.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.24 -0.436 . . . . 73.13 111.21 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -102.89 129.9 49.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 74.1 110.866 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -105.36 127.28 52.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 74.5 110.824 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -113.71 111.11 21.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.29 -0.414 . . . . 72.34 110.93 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -63.32 137.16 58.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.066 -0.516 . . . . 65.31 110.841 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 54.3 mt -119.66 109.43 26.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.139 -0.482 . . . . 74.23 111.132 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -84.63 121.4 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 74.01 110.954 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -110.5 98.11 7.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.327 -0.397 . . . . 72.21 111.013 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -132.03 142.65 49.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.463 . . . . 73.45 110.844 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.55 35.95 26.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 62.11 111.165 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 12.5 t 61.31 30.12 18.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 74.45 110.812 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -135.57 143.56 45.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.466 . . . . 75.24 110.942 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.0 mp -106.37 149.8 26.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 63.32 110.966 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.27 140.82 5.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 72.45 110.836 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 49.8 mt -115.61 -34.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 73.34 111.148 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.424 ' O ' ' CG ' ' A' ' 142' ' ' GLU . 31.6 p-10 -96.65 11.53 35.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 71.24 110.875 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 6.6 pt-20 45.76 30.73 0.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 74.1 110.898 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -131.88 -39.96 1.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.112 -0.494 . . . . 74.21 110.906 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.6 p -116.6 104.51 16.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 74.01 111.087 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -93.0 148.91 21.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 75.21 110.957 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -119.4 177.71 4.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 64.14 110.821 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -100.52 -15.52 17.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 72.42 110.919 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -165.81 172.12 12.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 70.24 110.883 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -22.57 59.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 73.21 110.912 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.2 ttp -62.73 -57.0 12.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.471 . . . . 75.51 110.84 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -66.17 -35.56 80.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.948 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.45 -49.9 71.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 74.45 110.923 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 73.8 t -64.01 -38.19 81.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.183 -0.462 . . . . 74.14 111.192 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.84 -38.17 67.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.11 -0.495 . . . . 63.32 110.926 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.24 -46.1 57.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 71.53 110.888 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -70.86 -11.28 60.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.217 -0.447 . . . . 73.33 110.938 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.4 m -92.2 -32.43 15.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.105 -0.498 . . . . 64.43 111.128 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 5.7 t -80.35 -25.64 39.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.304 -0.407 . . . . 71.51 111.078 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -157.53 158.06 34.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.304 -0.407 . . . . 75.34 110.853 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.89 -56.48 12.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 72.43 111.103 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 58.12 22.63 9.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 74.41 110.846 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.28 11.17 18.65 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.752 . . . . 71.02 112.466 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -105.62 134.5 48.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.928 0.394 . . . . 72.23 110.943 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 23.5 t -51.71 -29.71 19.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.148 -0.478 . . . . 73.34 110.849 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 3.0 t -153.03 120.44 5.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 70.5 111.116 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -53.54 143.0 20.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 73.5 110.913 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.7 mt -61.56 135.58 57.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 74.33 110.888 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 27.0 mt -127.19 -51.41 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 74.24 111.117 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.4 120.04 22.01 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.605 0.717 . . . . 74.32 110.841 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 133.83 26.48 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.699 2.266 . . . . 73.42 112.302 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.94 83.67 0.49 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 74.32 110.883 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.8 m -64.55 144.97 14.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 74.43 111.173 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 7.8 ptm . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 71.34 110.886 179.92 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.269 0 CA-C-O 121.505 0.503 . . . . 72.0 112.455 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 169.65 18.42 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.683 2.255 . . . . 71.03 112.383 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 6.5 mt -53.54 -46.93 70.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 74.5 110.859 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 108.15 -21.48 29.05 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.781 -0.724 . . . . 61.25 112.487 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 1.5 m -147.4 89.81 1.81 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.948 0.404 . . . . 74.42 110.838 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.76 100.79 1.62 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.09 -0.504 . . . . 71.04 110.856 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -172.19 170.86 5.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 75.31 110.887 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -159.57 64.92 0.37 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 73.35 110.932 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 10.3 p -176.42 79.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.091 -0.504 . . . . 71.14 110.863 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 33.3 t -130.26 109.19 10.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 62.11 110.899 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -164.07 110.74 1.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 62.42 110.915 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 3.3 t -110.17 88.4 2.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 75.35 110.883 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -83.46 149.43 26.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.211 -0.45 . . . . 74.33 110.975 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.71 129.39 10.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 75.54 110.891 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.25 170.89 9.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.209 -0.45 . . . . 55.13 110.888 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -63.8 -15.58 59.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 72.31 110.914 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.47 -38.58 91.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 73.34 110.848 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -104.08 -26.14 12.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.876 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -138.33 77.8 34.68 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.594 0.712 . . . . 64.32 110.897 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.73 -6.15 17.89 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.674 2.249 . . . . 64.12 112.308 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.3 t -93.64 27.27 2.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.434 . . . . 75.42 111.069 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 36.0 mt -103.11 136.65 42.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.269 -0.423 . . . . 72.5 110.997 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 11.7 t -107.12 173.69 6.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.438 . . . . 72.34 111.171 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 26.8 pt-20 -49.26 -37.63 24.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 72.32 110.793 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -61.38 -52.0 66.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 74.31 110.916 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -63.29 -52.45 61.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 63.42 110.878 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 46.2 mm -56.33 -54.06 32.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.468 . . . . 74.11 111.098 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 22.8 t -60.33 -19.92 57.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 75.31 110.882 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.0 3.0 28.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.092 -0.504 . . . . 71.32 111.102 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.8 mtm -115.49 14.46 16.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 64.12 110.887 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 16.2 t -105.73 -39.2 6.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.084 -1.417 . . . . 74.12 110.838 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.44 139.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.475 . . . . 71.12 110.87 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 5.6 m -50.93 122.24 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 73.42 111.188 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -131.85 80.88 1.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.932 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt -58.62 160.41 10.29 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.599 0.714 . . . . 74.41 110.917 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 111.53 2.84 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.707 2.272 . . . . 75.21 112.351 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 CA-C-O 119.14 -0.811 . . . . 63.41 112.472 179.978 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 CA-C-O 121.44 0.467 . . . . 63.21 112.494 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -32.04 19.1 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.698 2.265 . . . . 71.43 112.304 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.26 25.76 11.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 65.53 110.868 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.17 -55.15 25.55 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.73 -0.747 . . . . 55.4 112.536 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 25.1 t -118.74 28.91 8.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.898 0.38 . . . . 75.33 110.856 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.13 74.35 5.53 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.571 0.7 . . . . 75.14 110.824 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.84 -25.34 28.35 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.632 2.221 . . . . 73.31 112.324 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 47.1 p-90 -54.54 -27.18 36.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.251 -0.431 . . . . 75.12 110.899 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -87.45 99.48 12.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 64.41 110.997 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.6 -39.62 57.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.16 -0.473 . . . . 75.3 110.914 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.65 23.91 38.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.788 -0.72 . . . . 71.0 112.557 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.53 70.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.798 0.332 . . . . 75.34 110.913 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.4 mm -138.95 145.14 28.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.425 . . . . 74.31 111.152 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.7 p -97.4 177.17 5.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.21 -0.45 . . . . 73.34 111.154 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -39.33 89.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.221 -0.445 . . . . 74.1 110.919 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -64.04 -37.54 87.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 71.22 110.884 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -38.57 56.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 75.13 110.94 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.27 -36.45 79.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 71.13 111.044 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.61 -53.15 30.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 74.32 110.88 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.99 -34.51 78.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 73.14 110.876 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.29 -35.69 81.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 73.31 110.89 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -104.89 43.74 1.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 73.51 110.91 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.481 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.45 -59.94 5.37 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.604 0.716 . . . . 72.45 110.919 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.0 Cg_endo -69.81 122.66 9.32 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.647 2.232 . . . . 75.33 112.307 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 117.61 5.19 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.66 2.24 . . . . 75.01 112.369 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -154.99 103.48 2.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.196 -0.456 . . . . 75.32 110.938 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 10.8 p -56.14 111.93 1.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.456 . . . . 73.32 111.186 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.54 -10.8 5.79 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.77 -0.728 . . . . 74.23 112.546 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -87.8 111.83 21.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.329 . . . . 74.5 110.923 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.4 p90 -123.79 162.09 23.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 73.23 110.889 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.65 136.58 11.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.117 -0.492 . . . . 74.34 110.985 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 88.6 t -109.6 139.54 32.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 72.41 111.23 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.91 144.55 24.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 74.44 110.805 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.74 124.05 10.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 73.3 110.926 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.3 m -59.47 118.75 6.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 74.34 110.941 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.8 m -68.65 -56.38 8.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 75.02 111.215 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -70.49 -29.21 65.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.11 110.915 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -107.88 92.72 9.42 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.665 0.745 . . . . 75.35 110.878 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 112.94 3.22 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.612 2.208 . . . . 73.23 112.399 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.54 -4.84 24.72 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.699 -0.763 . . . . 64.23 112.499 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -121.17 -178.9 3.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.824 0.345 . . . . 72.23 110.857 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -125.52 171.5 10.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.431 . . . . 74.2 110.94 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 99.2 m -139.42 122.82 17.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 74.51 111.126 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.43 112.49 25.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 72.33 110.89 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 42.9 t -101.33 124.14 46.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 65.33 110.879 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.8 t -121.75 150.21 25.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 72.45 111.115 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.25 110.82 23.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 72.31 110.895 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.04 90.35 3.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.127 -0.488 . . . . 64.43 110.937 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 66.1 32.78 7.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 74.32 110.856 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.48 -13.8 63.93 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.758 -0.734 . . . . 72.51 112.507 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -87.89 146.39 25.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.835 0.35 . . . . 74.5 110.9 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 5.8 m -106.53 104.13 16.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.216 -0.447 . . . . 73.01 111.13 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -89.47 112.69 23.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 72.43 110.884 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -92.6 124.85 36.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 73.1 110.846 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -118.36 106.71 13.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 74.31 110.93 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 6.7 ttp-105 -70.23 136.77 50.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.056 -0.52 . . . . 71.15 110.863 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 58.2 mt -110.83 108.42 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 75.5 111.153 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.65 124.79 26.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 74.44 110.937 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -109.53 104.52 13.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 72.44 110.951 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -144.26 143.25 30.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.477 . . . . 75.24 110.913 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 60.39 39.93 18.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 63.22 111.128 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 56.87 24.09 8.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.254 -0.43 . . . . 72.43 110.843 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 7.3 mtmm -131.47 162.94 29.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.135 -0.484 . . . . 74.23 110.917 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.1 mt -124.52 148.57 47.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.214 -0.448 . . . . 75.43 110.943 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 7.2 t -166.44 145.75 5.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 64.33 110.908 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 56.1 mt -115.58 -28.75 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 74.32 111.123 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.441 ' O ' ' CG ' ' A' ' 142' ' ' GLU . 4.3 p30 -101.25 12.76 36.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 73.04 110.906 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.441 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 7.1 pt-20 46.9 27.93 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 71.31 110.906 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -133.12 -37.77 0.97 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.49 . . . . 65.15 110.899 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 1.4 t -110.65 104.64 17.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.092 -0.503 . . . . 74.13 111.077 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -97.56 138.05 35.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 72.44 110.97 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -114.43 176.52 5.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 72.01 110.909 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.58 -14.58 18.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 71.54 110.904 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -165.51 172.18 12.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 72.11 110.899 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.63 -22.4 58.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 73.12 110.91 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -62.73 -57.12 12.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 73.24 110.896 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.53 -36.3 83.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 71.32 110.976 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.21 -53.22 58.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 73.35 110.932 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 67.2 t -60.77 -37.52 76.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 75.25 111.11 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -55.06 -39.02 68.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 75.23 110.832 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -71.78 -46.54 57.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 75.21 110.884 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -66.37 -21.23 66.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 75.12 110.885 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 92.0 m -84.18 -31.28 25.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 73.13 111.131 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 61.7 m -78.29 -24.42 46.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 74.4 111.137 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -165.64 157.84 14.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 74.01 110.885 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.26 -58.26 6.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 70.31 111.089 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 53.92 27.54 7.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 71.51 110.855 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 118.88 3.99 13.13 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 53.41 112.509 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 9.5 mp -106.67 140.95 38.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 74.45 110.871 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 18.2 p -54.44 -26.38 30.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 72.0 110.885 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 9.0 t -162.64 129.55 3.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 74.41 111.105 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -53.13 161.39 0.86 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 74.34 110.777 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 10.4 mt -79.21 141.41 37.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 65.42 110.886 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 23.1 mt -127.18 -51.4 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 75.21 111.167 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.6 mtpt -130.13 123.18 20.59 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.577 0.703 . . . . 74.05 110.937 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 138.3 37.6 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.721 2.281 . . . . 72.4 112.303 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.1 83.62 0.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 73.12 110.931 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 21.1 t -64.2 136.9 25.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 73.34 111.089 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.6 ptt? . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 75.35 110.87 179.888 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.236 0 CA-C-O 121.424 0.458 . . . . 74.5 112.455 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 166.15 28.54 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.739 2.293 . . . . 74.21 112.296 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 9.5 mp -58.67 -29.83 66.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 75.34 110.907 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 65.75 24.78 71.49 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.727 -0.749 . . . . 74.22 112.488 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 1.2 m -68.22 102.59 1.39 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.906 0.384 . . . . 63.31 110.903 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.92 120.01 9.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 74.25 110.796 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -174.07 142.34 0.83 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 74.4 110.878 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -128.54 67.75 1.38 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 75.54 110.917 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.0 86.33 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 74.12 110.866 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 21.5 t -139.89 110.56 6.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.071 -0.513 . . . . 62.5 110.834 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -163.8 103.8 0.91 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 74.15 110.918 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 6.0 t -102.65 88.83 3.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 74.44 110.852 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -83.75 147.82 27.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.109 -0.496 . . . . 74.12 110.942 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -145.56 129.14 17.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.071 -0.513 . . . . 74.12 110.858 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.52 162.16 16.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 73.21 110.917 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -62.2 -16.89 56.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 75.23 110.838 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -36.88 84.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.434 . . . . 74.22 110.882 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -98.32 -19.98 17.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.489 . . . . 73.24 110.87 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -149.39 79.73 8.02 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.559 0.695 . . . . 63.54 110.791 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 -6.6 18.98 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.754 2.303 . . . . 73.43 112.315 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.6 t -94.11 27.27 2.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.44 . . . . 65.2 111.102 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 48.6 mt -100.24 136.92 39.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.225 -0.443 . . . . 70.41 110.933 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 12.0 t -107.75 174.53 5.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 61.52 111.133 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -50.07 -37.86 35.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.212 -0.449 . . . . 75.21 110.84 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -60.95 -49.71 76.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 74.54 110.925 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -66.69 -51.95 50.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.159 -0.473 . . . . 73.41 110.945 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 44.6 mm -56.05 -53.75 35.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.119 -0.491 . . . . 72.15 111.094 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 82.8 p -59.8 -25.24 64.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 74.31 110.806 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -77.98 -2.66 38.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.48 . . . . 74.2 111.071 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.09 -3.2 23.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 71.33 110.895 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.1 -32.43 10.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.159 -1.382 . . . . 73.11 110.871 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.29 155.65 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 74.42 110.865 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 4.7 m -51.38 121.31 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 72.2 111.13 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -135.92 74.96 1.53 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 65.12 110.797 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 22.1 mttt -55.34 160.54 3.47 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.63 0.729 . . . . 74.03 110.875 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.66 112.74 3.14 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.735 2.29 . . . . 75.31 112.392 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.364 0 CA-C-O 119.084 -0.842 . . . . 75.32 112.471 179.988 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 CA-C-O 121.444 0.469 . . . . 62.41 112.497 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.69 -8.1 22.72 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.703 2.269 . . . . 74.1 112.323 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.9 25.4 13.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.259 -0.428 . . . . 75.34 110.915 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.0 -47.95 17.43 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.749 -0.739 . . . . 55.34 112.442 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 5.5 m -165.98 49.6 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.859 0.362 . . . . 70.44 110.872 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.2 mtt -138.19 74.79 41.7 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.531 0.681 . . . . 72.22 110.842 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 -8.2 23.0 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.717 2.278 . . . . 64.23 112.348 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 45.0 p-90 -100.09 -28.25 13.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 75.33 110.902 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -83.55 102.19 11.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.418 . . . . 75.42 110.888 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -75.57 -38.65 59.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 64.23 110.818 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 59.27 18.14 41.38 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.719 -0.753 . . . . 72.24 112.494 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.96 80.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.68 0.276 . . . . 72.52 110.871 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.5 mm -145.82 145.41 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.321 -0.399 . . . . 74.52 111.181 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -100.21 176.85 5.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 72.02 111.156 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -43.29 97.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.22 -0.446 . . . . 71.21 110.865 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.31 -37.74 78.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 73.21 110.871 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -38.24 55.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 73.03 110.847 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.21 -38.47 85.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 71.52 111.106 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.88 -52.45 50.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 72.33 110.858 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -33.64 76.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 74.24 110.862 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 11.7 mt -60.74 -38.0 83.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 74.54 110.92 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 8.1 mp -105.77 43.18 1.15 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 73.12 110.891 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.483 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -61.39 -59.83 12.37 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.649 0.738 . . . . 74.42 110.917 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.77 124.2 10.85 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.695 2.263 . . . . 74.33 112.355 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.79 111.06 2.71 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.694 2.263 . . . . 75.34 112.273 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -148.99 123.28 9.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 72.33 110.954 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.97 111.66 8.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 71.42 111.174 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.79 -7.81 6.13 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.786 -0.721 . . . . 74.35 112.47 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -87.4 111.63 21.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.852 0.358 . . . . 72.31 110.98 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -125.33 160.17 29.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 74.4 110.839 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.1 pp -156.09 134.71 11.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.112 -0.495 . . . . 73.32 110.92 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 91.9 t -109.52 141.22 25.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.171 -0.468 . . . . 63.31 111.101 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -153.58 149.94 28.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.474 . . . . 74.43 110.826 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.81 124.28 10.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.917 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.6 t -57.32 104.93 0.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 71.15 110.817 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.7 m -68.68 -30.04 68.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 51.43 111.083 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.93 -30.55 61.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 65.42 110.928 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -139.64 116.09 8.3 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.636 0.731 . . . . 75.25 110.895 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 122.17 8.86 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.676 2.25 . . . . 70.03 112.349 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.4 -9.73 24.27 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.708 -0.758 . . . . 55.33 112.54 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -114.53 175.47 5.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.341 . . . . 62.24 110.871 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -132.57 146.55 51.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 73.43 110.911 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 3.3 m -116.71 138.84 51.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 74.12 111.097 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -112.82 115.93 29.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.48 . . . . 73.32 110.919 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.4 m -99.87 120.17 39.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.261 -0.427 . . . . 61.41 110.875 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.4 t -121.99 146.97 26.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 71.31 111.174 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.43 110.45 22.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.229 -0.442 . . . . 75.13 110.794 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.1 98.05 6.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.092 -0.504 . . . . 75.44 110.904 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 66.22 28.29 10.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 75.01 110.86 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.35 -14.91 63.0 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.77 -0.729 . . . . 44.43 112.512 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt -87.58 139.03 30.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.342 . . . . 75.21 110.986 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 11.0 m -99.67 109.68 25.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 74.12 111.124 179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -100.98 130.74 47.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 74.33 110.826 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -105.9 131.47 53.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 72.05 110.852 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -115.94 115.74 26.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 75.31 110.892 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -70.55 125.29 26.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.52 . . . . 71.41 110.865 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 79.6 mt -107.07 108.9 26.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 72.32 111.172 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 4.2 ttt -76.27 129.44 36.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.111 -0.495 . . . . 73.2 110.792 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -111.89 116.65 30.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 74.13 110.926 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -151.11 135.99 17.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.488 . . . . 72.5 110.846 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.02 35.89 23.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.52 111.126 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.5 27.16 15.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 70.34 110.873 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.73 136.07 51.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 74.44 110.895 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.2 mp -101.52 150.15 23.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.174 -0.466 . . . . 74.11 110.89 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 53.3 p -167.95 131.81 1.68 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 73.24 110.895 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 60.7 mt -105.8 -33.5 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 73.31 111.117 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -85.24 -0.36 54.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 74.51 110.869 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 60.53 17.72 7.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 62.51 110.889 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -132.53 -38.55 1.03 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 74.1 110.932 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.8 t -101.99 104.5 16.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.1 -0.5 . . . . 72.44 111.166 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -99.87 143.38 30.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 73.41 110.975 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -115.82 174.56 5.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 74.02 110.909 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -100.87 -3.52 29.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 73.22 110.888 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -176.51 157.87 1.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 74.4 110.879 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.3 mp -59.18 -44.08 92.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 70.52 110.953 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -36.25 36.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 74.42 110.858 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -75.21 -45.49 40.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 75.23 110.941 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.83 -42.52 75.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 62.42 110.961 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 75.5 t -66.6 -43.36 90.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 72.11 111.13 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -52.97 -37.34 61.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 64.22 110.915 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -72.3 -47.6 48.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 72.3 110.81 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -68.35 -15.59 63.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 73.14 110.943 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.3 m -86.76 -33.98 19.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.079 -0.51 . . . . 71.54 111.135 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 3.9 m -78.08 -25.37 47.6 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 55.14 111.076 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -157.5 161.67 38.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.244 -0.434 . . . . 74.22 110.853 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.65 -54.49 22.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 70.24 111.092 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 59.81 20.46 9.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 71.35 110.868 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 109.18 12.19 20.53 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.713 -0.756 . . . . 53.44 112.397 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.3 mp -105.89 136.93 44.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.794 0.331 . . . . 75.34 110.965 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 11.5 t -51.57 -29.69 18.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 74.25 110.812 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.9 t -152.67 120.24 6.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 64.01 111.118 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -50.97 146.1 6.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 75.05 110.901 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.0 mt -63.48 132.17 50.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 71.23 110.898 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' ILE . . . . . . . . . . . . . 23.9 mt -126.97 -51.39 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 73.41 111.184 179.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.3 mttm -123.87 119.25 26.83 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.54 0.686 . . . . 74.32 110.843 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 134.78 28.89 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.742 2.295 . . . . 55.24 112.362 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.99 84.46 0.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 71.13 110.898 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.7 m -64.42 129.89 28.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.221 -0.445 . . . . 73.53 111.153 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.6 mtt . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.24 -0.436 . . . . 71.1 110.914 179.861 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 CA-C-O 121.419 0.455 . . . . 70.23 112.485 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.69 167.61 23.85 Favored 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 122.726 2.284 . . . . 71.03 112.344 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 26.0 mt -63.2 -27.98 69.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.242 -0.435 . . . . 75.43 110.924 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 101.24 -39.87 2.61 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.813 -0.708 . . . . 52.42 112.482 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -141.98 148.24 38.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.009 0.433 . . . . 74.2 110.797 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -157.97 143.08 16.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.061 -0.518 . . . . 74.51 110.898 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.03 118.13 7.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 73.32 110.856 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -169.26 108.8 0.44 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.136 -0.483 . . . . 74.4 110.849 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 1.3 p -96.34 91.36 5.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 72.1 110.862 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 43.4 p -59.36 -175.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.176 -0.465 . . . . 73.43 110.816 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -162.17 92.25 0.82 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 73.14 110.983 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 6.2 t -82.95 89.07 6.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 75.32 110.868 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -79.95 148.42 31.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 75.21 110.917 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.21 128.53 13.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 74.2 110.935 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 20.3 m -89.57 162.14 15.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.292 -0.413 . . . . 70.44 110.888 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -59.33 -19.8 49.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 74.12 110.857 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -36.7 82.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 74.53 110.852 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -102.58 -10.56 19.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 74.14 110.933 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -157.58 78.6 3.56 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.662 0.744 . . . . 74.32 110.937 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.64 -6.7 19.17 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.77 2.314 . . . . 75.12 112.351 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 15.2 t -93.74 27.54 2.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.213 -0.449 . . . . 74.13 111.168 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 44.0 mt -101.74 138.25 38.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 75.41 110.955 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 10.8 t -107.52 172.97 6.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 74.52 111.132 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -50.09 -31.98 14.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.451 . . . . 62.15 110.967 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.72 -45.8 77.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.099 -0.501 . . . . 75.4 110.87 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 309' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -70.31 -51.67 28.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 65.1 110.872 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 40.5 mm -55.72 -53.09 41.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 74.4 111.189 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 35.0 t -63.97 -25.62 68.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 72.21 110.879 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -71.16 -9.75 58.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 74.11 111.144 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -106.53 14.47 27.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 72.3 110.902 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 86.1 p -113.66 -33.06 5.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.1 -1.409 . . . . 73.23 110.902 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 65.54 147.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 75.14 110.857 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 317' ' ' VAL . . . . . . . . . . . . . 12.3 m -51.23 116.84 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.084 -0.507 . . . . 74.41 111.164 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -125.24 75.04 1.42 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 64.53 110.839 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt -54.6 160.32 2.81 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.616 0.722 . . . . 74.14 110.875 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 111.41 2.81 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.716 2.277 . . . . 73.15 112.301 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 CA-C-O 119.161 -0.8 . . . . 72.22 112.527 -179.974 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.723 0.218 . . . . 75.319999999999993 112.319 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.444 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 48.9 p-90 -54.86 -26.32 34.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 64.140000000000001 110.915 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -89.17 100.55 13.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.27 -0.423 . . . . 71.109999999999999 110.885 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 -75.62 -37.06 60.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 75.540000000000006 110.834 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 56.24 20.56 29.27 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.703 -0.76 . . . . 65.310000000000002 112.501 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.32 79.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.684 0.278 . . . . 64.310000000000002 110.857 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.594 HG23 ' HB3' ' A' ' 91' ' ' GLN . 24.4 mm -144.19 144.82 22.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 75.430000000000007 111.076 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 p -96.57 177.08 5.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 34.439999999999998 111.167 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -66.03 -39.04 89.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.278 -0.419 . . . . 73.549999999999997 110.811 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -69.59 -34.75 74.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 71.299999999999997 110.893 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.594 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.3 OUTLIER -75.34 -36.63 61.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 64.400000000000006 110.899 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.06 -34.0 61.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 64.239999999999995 111.028 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.24 -53.4 37.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.234 -0.439 . . . . 61.5 110.855 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.87 -39.17 93.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 74.439999999999998 110.916 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 17.3 mt -57.5 -38.44 74.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 74.239999999999995 110.913 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.626 HD12 ' CB ' ' A' ' 121' ' ' SER . 2.7 mm? -101.89 43.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 73.340000000000003 110.931 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.487 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.93 -60.35 4.48 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.674 0.75 . . . . 75.340000000000003 110.982 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.71 123.13 9.82 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.735 2.29 . . . . 62.520000000000003 112.341 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 118.08 5.47 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.713 2.275 . . . . 64.340000000000003 112.273 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.89 104.4 2.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.445 . . . . 71.109999999999999 110.888 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 168' ' ' ILE . 2.6 p -56.82 111.93 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.108 -0.496 . . . . 71.409999999999997 111.143 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.85 -8.83 6.09 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.718 -0.753 . . . . 45.240000000000002 112.435 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.7 tp -89.74 111.78 22.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.84 0.352 . . . . 62.0 110.901 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -123.75 163.9 20.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 74.319999999999993 110.857 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.547 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -159.2 136.99 10.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.213 -0.449 . . . . 73.420000000000002 110.918 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.444 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 86.3 t -110.23 137.38 42.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.166 -0.47 . . . . 64.519999999999996 111.125 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -150.69 145.58 25.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 73.349999999999994 110.912 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.5 124.09 11.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 65.329999999999998 110.958 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 t -60.46 114.42 2.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.184 -0.462 . . . . 74.400000000000006 110.851 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.465 HG21 ' HB2' ' B' ' 298' ' ' SER . 2.3 m -68.73 -53.17 23.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 63.229999999999997 111.143 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.634 ' CG ' HD12 ' B' ' 310' ' ' ILE . 37.1 m-80 -63.49 -29.38 70.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 71.409999999999997 110.862 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -125.97 96.11 38.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.667 0.746 . . . . 73.129999999999995 110.947 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.66 127.09 14.17 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.69 2.26 . . . . 73.420000000000002 112.314 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.4 -15.72 22.37 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.72 -0.752 . . . . 51.009999999999998 112.472 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -117.59 179.23 4.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.89 0.376 . . . . 73.150000000000006 110.868 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' TYR . . . . . 0.638 ' CE2' HD21 ' A' ' 149' ' ' LEU . 55.7 m-85 -124.68 162.81 23.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.118 -0.492 . . . . 75.209999999999994 110.924 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 89.8 m -134.72 126.45 29.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.122 -0.49 . . . . 65.510000000000005 111.136 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.23 119.83 37.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 74.230000000000004 110.915 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.5 t -105.94 122.44 46.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 73.040000000000006 110.902 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.7 t -122.67 151.01 26.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.268 -0.423 . . . . 71.530000000000001 111.121 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.626 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -103.54 111.0 23.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 71.409999999999997 110.868 -179.858 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.47 94.59 4.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 71.530000000000001 110.881 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 66.23 29.88 9.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 72.400000000000006 110.905 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.87 -13.17 63.93 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.72 -0.753 . . . . 72.329999999999998 112.492 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -88.01 140.06 29.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.836 0.35 . . . . 73.120000000000005 110.906 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.448 ' O ' HG23 ' A' ' 126' ' ' VAL . 8.8 m -101.25 107.88 22.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 63.130000000000003 111.111 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -97.05 123.05 40.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 74.319999999999993 110.865 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -102.41 125.17 49.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 74.450000000000003 110.895 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -113.01 112.56 24.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 72.420000000000002 110.924 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.37 132.79 48.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.092 -0.504 . . . . 63.420000000000002 110.884 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.523 HG12 HD11 ' A' ' 140' ' ' ILE . 29.3 mt -113.19 110.1 30.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.224 -0.444 . . . . 74.439999999999998 111.18 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.04 128.56 34.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 62.100000000000001 110.904 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.448 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -115.42 101.37 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.411 . . . . 75.010000000000005 110.888 -179.863 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -136.49 142.57 43.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.479 . . . . 74.209999999999994 110.848 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.14 35.96 25.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 73.010000000000005 111.169 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.28 29.6 19.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 73.030000000000001 110.825 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -136.23 142.3 44.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.08 -0.509 . . . . 74.049999999999997 110.905 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.448 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 4.1 mp -103.86 150.06 24.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.25 -0.432 . . . . 70.040000000000006 110.9 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 33.8 t -167.37 140.45 3.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.161 -0.472 . . . . 74.219999999999999 110.846 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.596 HG22 HG13 ' B' ' 317' ' ' VAL . 58.9 mt -115.7 -28.76 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.143 -0.481 . . . . 60.299999999999997 111.125 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.59 ' HA ' HG21 ' B' ' 317' ' ' VAL . 6.1 p30 -95.28 -1.74 50.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 75.140000000000001 110.875 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 61.57 17.03 8.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 64.400000000000006 110.862 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -127.49 -33.99 2.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 35.43 110.882 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -112.21 104.58 17.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.112 -0.494 . . . . 63.32 111.09 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -97.79 143.98 27.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 71.540000000000006 111.01 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' PHE . . . . . 0.529 ' CD1' HD12 ' A' ' 152' ' ' LEU . 51.3 m-85 -118.55 178.07 4.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 71.200000000000003 110.875 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.55 -15.44 17.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 71.430000000000007 110.859 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -165.39 172.27 12.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.175 -0.466 . . . . 71.019999999999996 110.93 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.638 HD21 ' CE2' ' A' ' 116' ' ' TYR . 0.7 OUTLIER -74.63 -24.78 58.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.168 -0.469 . . . . 75.25 110.909 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.3 tmm? -61.54 -57.09 13.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.271 -0.422 . . . . 61.439999999999998 110.903 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.65 -36.1 82.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 63.310000000000002 110.94 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.529 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.69 -48.27 75.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.439 . . . . 73.049999999999997 110.92 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.52 HG13 HD12 ' A' ' 167' ' ' LEU . 73.6 t -64.84 -37.43 80.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 72.510000000000005 111.19 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -56.1 -38.12 70.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 74.209999999999994 110.887 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.09 -44.33 63.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.47 . . . . 75.5 110.879 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -71.1 -16.14 62.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 62.520000000000003 110.925 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 95.4 m -87.02 -33.3 19.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.501 . . . . 72.340000000000003 111.123 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.4 t -80.52 -24.29 39.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 63.409999999999997 111.153 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -157.47 155.01 29.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 71.129999999999995 110.845 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.18 -57.46 8.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 73.319999999999993 111.102 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 60.01 20.75 9.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 70.010000000000005 110.866 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.78 17.24 7.54 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.756 -0.735 . . . . 75.219999999999999 112.507 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 9.7 mp -111.18 139.13 46.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.833 0.349 . . . . 72.030000000000001 110.935 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 38.4 t -51.37 -31.76 23.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 55.409999999999997 110.904 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 5.3 t -156.02 124.42 5.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 33.140000000000001 111.174 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -51.43 146.87 6.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 73.129999999999995 110.78 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.52 HD12 HG13 ' A' ' 153' ' ' VAL . 7.7 mt -65.74 138.45 57.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.144 -0.48 . . . . 73.340000000000003 110.901 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 101' ' ' THR . 26.4 mt -127.24 -51.31 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.168 -0.469 . . . . 73.209999999999994 111.132 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 1.8 mmtp -129.2 121.98 20.87 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.605 0.717 . . . . 71.400000000000006 110.902 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 138.24 37.6 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.718 2.278 . . . . 62.420000000000002 112.3 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.46 83.36 0.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 65.049999999999997 110.88 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.5 m -64.46 134.91 28.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 63.43 111.148 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.5 ptm . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 51.539999999999999 110.853 179.943 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.437 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.812 0.339 . . . . 62.100000000000001 110.944 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.6 t -96.2 88.95 4.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 53.229999999999997 110.882 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -71.47 147.09 48.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 51.310000000000002 110.869 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.06 129.48 21.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.11 -0.495 . . . . 72.109999999999999 110.869 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 298' ' ' SER . . . . . 0.465 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -93.86 161.29 14.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 33.049999999999997 110.851 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -61.33 -17.74 55.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 74.150000000000006 110.875 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -36.99 84.62 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.132 -0.485 . . . . 73.439999999999998 110.914 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -100.33 -20.61 15.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 74.340000000000003 110.933 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.514 ' HB2' HD11 ' B' ' 305' ' ' LEU . 23.8 m-20 -147.82 79.07 9.52 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.619 0.724 . . . . 63.539999999999999 110.825 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -6.54 18.85 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.678 2.252 . . . . 72.120000000000005 112.35 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.3 t -94.05 27.47 2.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.23 -0.441 . . . . 62.409999999999997 111.129 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' B' ' 302' ' ' ASP . 47.6 mt -100.64 136.94 39.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.247 -0.433 . . . . 72.400000000000006 110.875 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.607 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.2 t -108.96 172.34 6.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 62.409999999999997 111.158 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -48.98 -34.16 12.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.2 -0.455 . . . . 71.0 110.93 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 308' ' ' GLU . . . . . 0.418 ' H ' HG23 ' B' ' 306' ' ' THR . 2.7 mt-10 -64.28 -45.09 89.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 72.319999999999993 110.895 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.607 ' HG2' HG22 ' B' ' 306' ' ' THR . 10.4 mm-40 -74.31 -50.21 19.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.49 . . . . 71.140000000000001 110.847 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.634 HD12 ' CG ' ' A' ' 111' ' ' ASN . 40.6 mm -55.69 -53.05 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 62.420000000000002 111.131 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 25.0 m -62.74 -32.48 73.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 54.109999999999999 110.851 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -62.88 -16.56 59.27 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.146 -0.479 . . . . 75.150000000000006 111.145 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 53.340000000000003 110.905 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.846 0.355 . . . . 74.010000000000005 110.864 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 3.1 m 63.88 158.03 0.08 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 61.229999999999997 110.876 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.596 HG13 HG22 ' A' ' 140' ' ' ILE . 4.7 m -51.61 123.21 2.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.145 -0.479 . . . . 63.439999999999998 111.196 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -137.87 77.67 1.64 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 73.200000000000003 110.852 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp . . . . . 0 C--N 1.329 -0.293 0 CA-C-O 121.534 0.683 . . . . 75.540000000000006 110.957 179.909 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.153 0 CA-C-O 120.737 0.224 . . . . 53.409999999999997 112.316 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.415 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 38.0 p-90 -102.76 -30.13 11.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 75.430000000000007 110.871 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -87.42 97.22 10.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 75.420000000000002 110.908 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.2 m80 -75.77 -37.48 59.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 72.019999999999996 110.894 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.7 25.94 56.57 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.704 -0.76 . . . . 54.240000000000002 112.474 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.26 67.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.726 0.298 . . . . 72.209999999999994 110.91 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 15.5 mm -128.41 144.12 38.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 73.209999999999994 111.111 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.459 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -94.87 171.23 8.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.153 -0.476 . . . . 74.329999999999998 111.198 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.459 ' H ' HG22 ' A' ' 88' ' ' THR . 7.1 ppt_? -62.03 -39.08 91.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 74.450000000000003 110.829 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -75.15 -32.8 61.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 55.539999999999999 110.952 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -69.97 -41.38 74.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.161 -0.472 . . . . 73.219999999999999 110.888 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.606 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -74.26 -36.55 63.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 71.340000000000003 111.051 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.64 -53.21 60.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 75.319999999999993 110.887 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.45 -34.08 76.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 71.299999999999997 110.884 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.606 HD12 ' HA ' ' A' ' 92' ' ' ALA . 9.5 mt -54.88 -38.42 67.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 71.140000000000001 110.938 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.775 HD21 HD23 ' A' ' 105' ' ' LEU . 3.9 mm? -100.27 43.57 1.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 70.5 110.894 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.514 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.38 -59.47 4.91 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.712 0.768 . . . . 72.430000000000007 110.902 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 52.7 Cg_endo -69.78 123.74 10.39 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.74 2.294 . . . . 73.109999999999999 112.304 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 115.63 4.19 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.639 2.226 . . . . 73.200000000000003 112.3 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -155.34 121.03 5.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.254 -0.43 . . . . 62.240000000000002 110.871 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.682 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.8 OUTLIER -72.39 111.74 7.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.097 -0.501 . . . . 64.030000000000001 111.128 -179.906 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.28 -4.32 6.76 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.696 -0.764 . . . . 51.240000000000002 112.481 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.544 HD12 ' O ' ' A' ' 169' ' ' LYS . 3.8 tp -90.24 120.92 31.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.908 0.385 . . . . 75.230000000000004 110.895 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.463 ' HB3' HD22 ' A' ' 167' ' ' LEU . 23.7 p90 -133.05 175.94 8.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.118 -0.492 . . . . 65.120000000000005 110.919 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.775 HD23 HD21 ' A' ' 96' ' ' LEU . 0.9 OUTLIER -169.47 134.27 1.43 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 74.25 110.863 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.415 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 84.7 t -110.93 131.4 62.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 34.299999999999997 111.161 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.66 150.81 36.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 74.5 110.863 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -57.5 124.08 17.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 74.530000000000001 110.927 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.5 m -57.94 117.1 3.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 72.310000000000002 110.868 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.9 m -69.01 -56.17 8.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 64.319999999999993 111.071 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -71.97 -26.76 62.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 63.020000000000003 110.913 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -108.42 90.63 7.31 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.655 0.74 . . . . 62.130000000000003 110.922 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 113.56 3.41 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.71 2.273 . . . . 73.030000000000001 112.339 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.44 2.62 24.4 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.704 -0.76 . . . . 73.239999999999995 112.512 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -130.78 -172.62 2.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.82 0.343 . . . . 71.109999999999999 110.853 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -140.52 145.23 36.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 75.239999999999995 110.882 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 31.6 m -108.95 128.22 54.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 64.319999999999993 111.12 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.488 HD23 ' HB2' ' A' ' 129' ' ' TYR . 0.4 OUTLIER -110.86 104.7 13.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 72.219999999999999 110.916 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.3 m -87.21 153.91 21.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.185 -0.461 . . . . 64.040000000000006 110.843 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.633 HG21 HD12 ' A' ' 163' ' ' LEU . 12.8 t -146.58 142.66 20.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 64.120000000000005 111.192 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.62 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.3 OUTLIER -92.13 111.29 22.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 64.549999999999997 110.803 -179.803 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -123.23 93.55 3.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 75.439999999999998 110.905 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 67.5 29.27 7.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 71.329999999999998 110.837 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.68 -19.05 56.18 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.741 -0.742 . . . . 52.100000000000001 112.464 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -87.44 136.68 32.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.851 0.358 . . . . 73.150000000000006 110.891 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.52 ' O ' HD13 ' B' ' 294' ' ' LEU . 4.1 p -97.26 106.73 18.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 74.430000000000007 111.105 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -91.95 120.19 32.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.123 -0.49 . . . . 64.400000000000006 110.924 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -87.79 124.72 33.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 72.430000000000007 110.878 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.686 ' CZ ' HD13 ' A' ' 163' ' ' LEU . 57.0 m-85 -114.14 106.8 14.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 75.400000000000006 110.919 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -64.06 141.28 58.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 73.310000000000002 110.905 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.433 HG21 HD23 ' A' ' 138' ' ' LEU . 61.9 mt -123.25 111.25 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 64.430000000000007 111.13 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.32 125.07 31.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 65.299999999999997 110.862 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.492 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -111.77 98.27 7.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 75.310000000000002 110.947 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -130.83 142.56 50.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 44.439999999999998 110.872 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.2 35.96 25.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 73.140000000000001 111.182 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.44 29.32 18.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.473 . . . . 62.310000000000002 110.861 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mtmm -134.1 139.93 46.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 65.340000000000003 110.91 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.492 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 4.8 mp -102.01 149.21 24.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.271 -0.422 . . . . 70.340000000000003 110.934 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.2 p -165.69 140.57 4.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 71.109999999999999 110.901 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.532 HG22 HG13 ' B' ' 317' ' ' VAL . 50.1 mt -115.56 -32.5 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 73.120000000000005 111.155 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.561 ' HA ' HG21 ' B' ' 317' ' ' VAL . 40.3 t0 -89.64 1.14 56.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 75.420000000000002 110.918 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 60.53 17.81 7.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 74.549999999999997 110.865 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -132.43 -38.59 1.04 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 73.120000000000005 110.88 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.48 104.6 16.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 71.530000000000001 111.104 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -99.95 144.58 28.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 73.120000000000005 110.933 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' PHE . . . . . 0.482 ' CD1' HD12 ' A' ' 152' ' ' LEU . 57.7 m-85 -117.89 177.77 4.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 74.409999999999997 110.896 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.65 -15.31 17.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 74.319999999999993 110.919 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -166.06 172.13 11.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 75.5 110.933 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.6 -24.45 58.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.202 -0.454 . . . . 73.140000000000001 110.943 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.88 -56.94 14.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 71.109999999999999 110.904 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.95 -35.33 80.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 65.140000000000001 110.917 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.482 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.59 -52.4 63.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.463 . . . . 62.240000000000002 110.924 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.696 HG13 HD12 ' A' ' 167' ' ' LEU . 85.3 t -62.77 -36.63 76.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 44.030000000000001 111.099 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -55.51 -39.09 70.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 41.020000000000003 110.856 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -72.08 -44.18 63.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 64.540000000000006 110.857 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.405 ' CD1' HD23 ' A' ' 163' ' ' LEU . 30.2 m-85 -67.91 -21.94 65.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.445 . . . . 50.119999999999997 110.929 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.529 HG23 ' O ' ' A' ' 167' ' ' LEU . 63.0 m -84.57 -30.2 25.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.081 -0.508 . . . . 71.099999999999994 111.172 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 93.5 m -79.84 -24.01 41.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.191 -0.459 . . . . 75.420000000000002 111.18 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -163.15 159.54 23.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 72.329999999999998 110.835 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.25 -57.99 7.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 73.230000000000004 111.047 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 57.04 24.18 9.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.212 -0.449 . . . . 72.329999999999998 110.891 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 112.75 0.89 25.86 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.707 -0.759 . . . . 75.129999999999995 112.471 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.686 HD13 ' CZ ' ' A' ' 129' ' ' TYR . 4.0 mm? -95.71 136.22 36.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.923 0.392 . . . . 41.439999999999998 110.922 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 49.3 t -51.82 -28.94 17.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.15 -0.477 . . . . 64.239999999999995 110.908 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.2 t -156.97 123.46 4.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.123 -0.489 . . . . 64.5 111.102 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -51.49 139.99 18.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.231 -0.44 . . . . 70.510000000000005 110.892 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.696 HD12 HG13 ' A' ' 153' ' ' VAL . 8.6 mt -62.32 135.81 57.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 73.420000000000002 110.946 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.682 HD12 ' O ' ' A' ' 101' ' ' THR . 29.3 mt -127.05 -51.4 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.431 . . . . 75.129999999999995 111.18 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 169' ' ' LYS . . . . . 0.544 ' O ' HD12 ' A' ' 103' ' ' LEU . 21.3 mttt -126.88 118.29 22.34 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.574 0.702 . . . . 74.239999999999995 110.881 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 138.15 37.15 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.757 2.305 . . . . 73.409999999999997 112.373 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 171' ' ' LYS . . . . . 0.409 ' HD3' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -68.18 84.9 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 55.219999999999999 110.913 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 33.9 m -64.34 138.8 22.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 73.430000000000007 111.174 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.1 ptm . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 74.049999999999997 110.854 179.892 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.866 0.365 . . . . 74.25 110.919 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 28.4 t -92.47 88.65 6.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 73.340000000000003 110.856 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -71.62 147.69 47.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.47 . . . . 70.019999999999996 110.934 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 297' ' ' LYS . . . . . 0.4 ' HB2' ' HE1' ' B' ' 313' ' ' MET . 1.5 mtpp -154.0 129.46 9.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 72.430000000000007 110.921 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.61 175.3 5.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 71.430000000000007 110.887 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 41.8 mtt180 -63.7 -16.0 59.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 75.409999999999997 110.913 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.04 -42.12 98.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 74.030000000000001 110.903 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -103.12 -15.55 16.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 74.319999999999993 110.925 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.528 ' HB2' HD11 ' B' ' 305' ' ' LEU . 5.4 m-20 -151.37 78.16 7.13 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.551 0.691 . . . . 75.109999999999999 110.801 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 -6.28 18.25 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.606 2.204 . . . . 74.540000000000006 112.326 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.7 t -93.4 27.23 2.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 70.329999999999998 111.096 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.528 HD11 ' HB2' ' B' ' 302' ' ' ASP . 36.8 mt -103.48 137.81 41.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.217 -0.447 . . . . 72.030000000000001 110.888 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.606 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -103.48 173.52 6.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 72.129999999999995 111.118 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.87 -35.23 22.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 74.310000000000002 110.838 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 308' ' ' GLU . . . . . 0.409 ' H ' HG23 ' B' ' 306' ' ' THR . 6.0 tt0 -63.28 -48.32 78.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.187 -0.461 . . . . 62.25 110.927 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.606 ' HG2' HG22 ' B' ' 306' ' ' THR . 2.9 mm-40 -66.43 -52.27 48.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 74.109999999999999 110.897 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 45.8 mm -56.82 -45.75 83.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 60.539999999999999 111.12 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 32.6 p -72.5 -15.94 61.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 71.349999999999994 110.904 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -81.98 1.75 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.119 -0.491 . . . . 74.340000000000003 111.115 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 313' ' ' MET . . . . . 0.4 ' HE1' ' HB2' ' B' ' 297' ' ' LYS . 2.3 mtt . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 72.400000000000006 110.833 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 27.3 t . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.897 0.379 . . . . 73.439999999999998 110.935 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 6.0 t 65.06 150.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.089 -0.505 . . . . 75.310000000000002 110.9 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.561 HG21 ' HA ' ' A' ' 141' ' ' ASP . 4.3 m -51.64 123.07 2.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.094 -0.503 . . . . 73.25 111.121 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -134.49 75.0 1.56 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.485 . . . . 75.120000000000005 110.875 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.1 mtmp? . . . . . 0 C--N 1.329 -0.299 0 CA-C-O 121.571 0.7 . . . . 73.129999999999995 110.857 179.911 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.465 -0.162 0 CA-C-O 120.763 0.235 . . . . 72.129999999999995 112.412 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.451 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 49.5 p-90 -54.89 -25.68 30.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 63.340000000000003 110.921 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -90.36 99.22 12.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 73.310000000000002 110.881 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -75.89 -40.69 53.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.119 -0.491 . . . . 72.349999999999994 110.778 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.83 24.84 54.91 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.732 -0.747 . . . . 70.129999999999995 112.512 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.79 65.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.815 0.34 . . . . 62.109999999999999 110.93 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.475 ' CG2' ' HB2' ' A' ' 92' ' ' ALA . 12.3 mm -129.73 144.21 38.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.145 -0.48 . . . . 63.119999999999997 111.081 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.456 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -99.77 177.17 5.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 75.099999999999994 111.175 179.878 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.456 ' H ' HG22 ' A' ' 88' ' ' THR . 2.3 ppt_? -64.59 -40.84 96.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 73.230000000000004 110.88 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -71.53 -34.74 70.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 74.420000000000002 110.869 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -73.29 -42.27 62.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 61.039999999999999 110.882 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 87' ' ' ILE . . . -74.17 -33.81 63.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 74.400000000000006 111.098 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.496 ' OE2' HG21 ' A' ' 126' ' ' VAL . 24.0 mm-40 -62.2 -53.25 57.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 53.439999999999998 110.857 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -35.01 79.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 72.109999999999999 110.843 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 12.9 mt -59.09 -36.19 74.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 74.219999999999999 110.917 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.635 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -104.43 43.48 1.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 61.310000000000002 110.9 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.56 -59.98 5.22 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.675 0.75 . . . . 65.450000000000003 110.94 -179.999 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.5 Cg_endo -69.86 123.51 10.14 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.641 2.227 . . . . 74.530000000000001 112.311 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 117.35 5.03 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.608 2.206 . . . . 62.130000000000003 112.379 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -154.84 115.2 3.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 65.099999999999994 110.863 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.643 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.2 OUTLIER -66.53 111.91 3.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 63.109999999999999 111.2 -179.908 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.5 -6.47 6.26 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.695 -0.764 . . . . 64.010000000000005 112.452 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.6 tp -90.47 111.75 23.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.83 0.347 . . . . 63.020000000000003 110.936 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.501 ' HB3' HD22 ' A' ' 167' ' ' LEU . 22.3 p90 -124.43 163.66 21.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.462 . . . . 71.430000000000007 110.866 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.587 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -159.49 137.11 9.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.478 . . . . 74.310000000000002 110.902 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.451 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 92.2 t -110.22 137.89 40.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 75.129999999999995 111.157 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.71 145.76 26.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.148 -0.478 . . . . 65.019999999999996 110.938 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -51.9 124.22 12.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 61.149999999999999 110.881 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.7 m -58.31 110.96 1.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 61.149999999999999 110.81 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.502 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.8 m -68.82 -54.67 14.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 72.099999999999994 111.161 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.625 ' CG ' HD12 ' B' ' 310' ' ' ILE . 34.2 m-80 -63.72 -27.92 69.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 72.310000000000002 110.859 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.418 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 5.2 m-85 -123.14 95.28 46.05 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.659 0.742 . . . . 74.239999999999995 110.898 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.9 Cg_endo -69.7 122.64 9.33 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.672 2.248 . . . . 73.329999999999998 112.364 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.49 -2.32 24.94 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.745 -0.741 . . . . 55.340000000000003 112.476 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -131.09 -175.94 3.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.856 0.36 . . . . 73.540000000000006 110.822 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -131.54 164.57 25.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 74.319999999999993 110.915 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.8 m -135.93 139.48 43.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 53.43 111.134 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.448 HD23 ' CD1' ' A' ' 129' ' ' TYR . 0.4 OUTLIER -109.98 117.18 33.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.199 -0.455 . . . . 75.129999999999995 110.95 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.3 m -101.52 123.93 46.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 71.019999999999996 110.896 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.3 t -123.12 151.72 27.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 73.340000000000003 111.136 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.635 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -101.09 111.59 23.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 73.430000000000007 110.882 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.43 91.04 3.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.13 -0.486 . . . . 72.150000000000006 110.943 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 67.12 30.72 7.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 74.349999999999994 110.826 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.95 -14.83 62.4 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.822 -0.704 . . . . 31.100000000000001 112.505 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.3 ptpt -88.11 140.18 29.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.813 0.34 . . . . 64.140000000000001 110.885 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.519 ' O ' HD22 ' B' ' 294' ' ' LEU . 8.6 m -99.94 108.9 23.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.253 -0.431 . . . . 63.130000000000003 111.085 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -95.9 121.8 38.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 71.549999999999997 110.929 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -99.73 124.67 45.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 65.540000000000006 110.892 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.448 ' CD1' HD23 ' A' ' 118' ' ' LEU . 74.1 m-85 -111.13 117.23 32.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 74.540000000000006 110.92 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -67.64 132.29 47.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 71.349999999999994 110.871 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.457 ' CG2' HD23 ' A' ' 138' ' ' LEU . 55.1 mt -113.56 107.57 23.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 74.120000000000005 111.116 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.9 ttm -83.92 122.56 28.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.19 -0.459 . . . . 62.329999999999998 110.902 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.448 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -111.29 99.4 8.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 53.32 110.913 -179.845 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -133.44 142.54 48.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 75.329999999999998 110.927 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 57.21 35.96 26.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.298 -0.41 . . . . 75.540000000000006 111.126 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.7 t 60.85 28.12 17.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 61.32 110.91 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.12 140.67 45.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 75.230000000000004 110.902 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.457 HD23 ' CG2' ' A' ' 131' ' ' ILE . 4.0 mp -102.2 147.65 26.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 65.530000000000001 110.911 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.95 137.66 5.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 53.039999999999999 110.828 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.502 HG22 HG13 ' B' ' 317' ' ' VAL . 51.0 mt -113.35 -31.93 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 74.239999999999995 111.152 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.564 ' HA ' HG21 ' B' ' 317' ' ' VAL . 40.7 t0 -90.52 1.2 56.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 71.549999999999997 110.894 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 60.62 17.81 7.81 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 60.5 110.899 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -132.43 -38.7 1.04 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 65.420000000000002 110.912 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.27 104.64 16.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 44.229999999999997 111.141 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -100.0 143.26 30.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 73.340000000000003 110.86 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' PHE . . . . . 0.509 ' CD1' HD12 ' A' ' 152' ' ' LEU . 60.3 m-85 -117.83 175.14 5.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 73.099999999999994 110.87 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.63 -1.91 34.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.505 . . . . 71.230000000000004 110.88 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.425 ' C ' HD13 ' A' ' 138' ' ' LEU . 0.8 OUTLIER -179.31 172.23 1.22 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 71.430000000000007 110.884 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.411 ' O ' HG23 ' A' ' 153' ' ' VAL . 0.7 OUTLIER -75.24 -28.18 59.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 65.349999999999994 110.925 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.0 ttt -58.03 -57.21 13.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 72.25 110.843 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -65.69 -37.31 86.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 73.439999999999998 110.944 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.509 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.4 OUTLIER -55.43 -46.91 76.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 63.32 110.949 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.434 HG13 ' CD1' ' A' ' 167' ' ' LEU . 69.3 t -64.6 -39.47 85.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 75.439999999999998 111.152 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -54.83 -38.72 67.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.103 -0.498 . . . . 73.299999999999997 110.949 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.31 -45.43 63.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 74.129999999999995 110.887 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.426 ' CD1' HD13 ' A' ' 163' ' ' LEU . 31.9 m-85 -67.22 -21.98 65.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 75.450000000000003 110.935 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.424 HG23 ' O ' ' A' ' 167' ' ' LEU . 58.7 m -84.15 -29.95 26.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 73.329999999999998 111.139 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 86.4 m -78.13 -27.0 48.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.203 -0.453 . . . . 61.520000000000003 111.121 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -164.71 155.65 14.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.245 -0.434 . . . . 75.510000000000005 110.838 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' ALA . . . . . 0.532 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -51.35 -58.2 6.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.135 -0.484 . . . . 75.109999999999999 111.092 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 52.51 28.97 6.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 72.25 110.873 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 121.89 -2.54 10.88 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.712 -0.756 . . . . 74.420000000000002 112.514 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.532 ' O ' ' HB1' ' A' ' 160' ' ' ALA . 9.6 mp -101.62 136.45 41.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.786 0.327 . . . . 72.120000000000005 110.969 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 164' ' ' CYS . . . . . 0.473 ' SG ' HG22 ' A' ' 165' ' ' THR . 19.5 p -54.42 -26.72 32.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.169 -0.469 . . . . 72.140000000000001 110.894 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.473 HG22 ' SG ' ' A' ' 164' ' ' CYS . 9.0 t -157.31 125.09 5.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.103 -0.499 . . . . 70.099999999999994 111.126 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -51.96 164.99 0.23 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 73.340000000000003 110.845 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.501 HD22 ' HB3' ' A' ' 104' ' ' PHE . 11.5 mt -84.58 138.72 32.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 71.400000000000006 110.924 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.643 HD12 ' O ' ' A' ' 101' ' ' THR . 27.7 mt -127.22 -51.22 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 75.030000000000001 111.106 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -128.58 121.22 21.11 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.533 0.682 . . . . 41.32 110.935 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.84 136.99 34.19 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.633 2.222 . . . . 71.140000000000001 112.31 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.41 83.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 74.299999999999997 110.88 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 26.9 m -64.64 133.1 30.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 45.409999999999997 111.136 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 37.6 mtm . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 72.030000000000001 110.822 179.929 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.519 HD22 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.799 0.333 . . . . 75.030000000000001 110.876 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.25 88.83 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 63.43 110.837 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -72.61 146.9 46.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 75.25 110.904 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -140.82 129.23 22.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.081 -0.509 . . . . 70.510000000000005 110.822 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 298' ' ' SER . . . . . 0.502 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -92.31 156.21 17.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 55.43 110.856 -179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -59.17 -19.37 44.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.092 -0.504 . . . . 72.109999999999999 110.843 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.7 -39.5 88.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 74.420000000000002 110.867 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -96.2 -20.16 18.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.46 . . . . 71.430000000000007 111.017 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.476 ' HB2' HD11 ' B' ' 305' ' ' LEU . 41.9 m-20 -147.34 77.77 10.51 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.596 0.712 . . . . 72.310000000000002 110.888 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -6.37 18.41 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.716 2.277 . . . . 71.239999999999995 112.349 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.2 t -93.79 27.45 2.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.249 -0.432 . . . . 65.040000000000006 111.167 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.476 HD11 ' HB2' ' B' ' 302' ' ' ASP . 42.1 mt -100.56 136.79 39.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 75.340000000000003 110.979 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.621 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -106.45 173.76 6.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 62.340000000000003 111.083 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -49.92 -37.45 31.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 62.229999999999997 110.89 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -60.87 -50.68 72.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 75.109999999999999 110.877 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.621 ' HG2' HG22 ' B' ' 306' ' ' THR . 16.6 mm-40 -66.21 -52.04 51.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 71.340000000000003 110.907 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.625 HD12 ' CG ' ' A' ' 111' ' ' ASN . 44.7 mm -56.04 -53.5 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 73.439999999999998 111.092 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 20.1 m -64.18 -19.05 65.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 73.439999999999998 110.832 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.28 3.79 26.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.101 -0.5 . . . . 35.049999999999997 111.134 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 72.400000000000006 110.818 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.892 0.377 . . . . 72.109999999999999 110.88 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.34 155.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 70.420000000000002 110.866 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.564 HG21 ' HA ' ' A' ' 141' ' ' ASP . 4.3 m -51.74 120.54 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 62.210000000000001 111.145 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -135.43 74.66 1.52 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 75.400000000000006 110.955 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.596 0.712 . . . . 63.340000000000003 110.922 179.972 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.133 0 CA-C-O 120.773 0.239 . . . . 51.409999999999997 112.285 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 46.9 p-90 -54.44 -27.1 34.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.261 -0.427 . . . . 64.439999999999998 110.915 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -86.52 100.83 12.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 73.319999999999993 110.924 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -75.81 -39.42 56.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 73.340000000000003 110.894 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.28 22.7 45.06 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.787 -0.72 . . . . 53.210000000000001 112.495 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 pttt 179.01 68.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.717 0.294 . . . . 73.019999999999996 110.872 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 mm -133.7 144.21 36.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 74.209999999999994 111.138 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.454 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -101.23 177.03 5.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.472 . . . . 73.409999999999997 111.176 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.454 ' H ' HG22 ' A' ' 88' ' ' THR . 0.0 OUTLIER -63.76 -43.57 96.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 74.010000000000005 110.84 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.44 -32.52 72.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 74.140000000000001 110.897 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.61 -43.16 49.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.128 -0.487 . . . . 71.409999999999997 110.934 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.83 -33.57 64.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 63.420000000000002 111.129 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -63.34 -53.29 54.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 61.32 110.883 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.08 -34.92 79.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 73.439999999999998 110.849 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 13.5 mt -60.56 -35.78 76.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 73.540000000000006 110.974 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.674 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -102.32 43.55 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 64.400000000000006 110.861 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.24 -60.04 5.48 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.673 0.749 . . . . 73.129999999999995 110.917 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.82 123.17 9.82 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.727 2.284 . . . . 74.5 112.345 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 117.82 5.31 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.63 2.22 . . . . 74.25 112.396 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -154.81 104.79 2.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 71.409999999999997 110.916 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.641 ' O ' HD12 ' A' ' 168' ' ' ILE . 33.2 p -57.98 111.92 1.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 33.32 111.165 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.05 -7.2 6.07 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.772 -0.728 . . . . 41.439999999999998 112.522 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.02 113.61 25.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.886 0.375 . . . . 63.219999999999999 110.899 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 27.0 p90 -125.22 165.2 18.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 75.099999999999994 110.853 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.621 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -161.54 137.28 7.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 64.129999999999995 110.939 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 89.0 t -110.19 142.88 21.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 74.120000000000005 111.132 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.96 148.83 25.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 73.349999999999994 110.855 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -52.08 124.21 12.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 73.349999999999994 110.916 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.2 m -59.81 117.31 4.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 55.109999999999999 110.928 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.59 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.3 m -69.12 -56.42 7.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.482 . . . . 50.219999999999999 111.146 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.456 ' H ' ' ND2' ' A' ' 111' ' ' ASN . 0.9 OUTLIER -70.96 -24.0 62.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 75.010000000000005 110.899 179.991 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -113.28 93.51 26.72 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.727 0.775 . . . . 74.319999999999993 110.94 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 111.07 2.7 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.721 2.28 . . . . 71.329999999999998 112.38 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.6 0.14 24.7 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.768 -0.73 . . . . 24.129999999999999 112.53 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -125.29 -175.88 3.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.797 0.332 . . . . 73.219999999999999 110.867 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -137.38 148.0 45.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 70.510000000000005 110.916 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 25.4 m -115.51 141.68 47.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.108 -0.496 . . . . 73.409999999999997 111.156 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.412 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.4 OUTLIER -111.79 116.56 30.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 73.200000000000003 110.911 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.1 t -100.65 129.16 46.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 74.230000000000004 110.911 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.412 ' CG2' HD21 ' A' ' 118' ' ' LEU . 17.3 t -130.03 149.11 33.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 73.310000000000002 111.066 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.674 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -101.07 111.03 23.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 61.030000000000001 110.852 -179.784 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.47 93.5 4.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 74.219999999999999 110.901 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 66.14 30.78 9.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 73.420000000000002 110.839 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.6 -14.3 63.29 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.73 -0.748 . . . . 74.219999999999999 112.536 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -88.08 147.5 24.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.756 0.312 . . . . 72.219999999999999 110.926 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.425 ' O ' HG23 ' A' ' 126' ' ' VAL . 7.0 m -105.51 109.22 27.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 62.43 111.14 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -96.94 113.7 25.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 72.329999999999998 110.865 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -91.13 124.65 35.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 74.239999999999995 110.815 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.638 ' CZ ' HD13 ' A' ' 163' ' ' LEU . 48.5 m-85 -114.08 116.19 28.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.218 -0.446 . . . . 72.310000000000002 110.909 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.48 137.07 46.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.102 -0.499 . . . . 70.450000000000003 110.872 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 26.0 mt -119.7 109.62 26.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 74.140000000000001 111.113 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -81.3 124.72 29.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.272 -0.422 . . . . 64.329999999999998 110.902 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.494 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -111.67 98.29 7.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.307 -0.406 . . . . 72.530000000000001 110.937 -179.875 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -132.06 142.57 49.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 72.400000000000006 110.897 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.18 35.97 26.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 74.439999999999998 111.073 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.38 26.6 16.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 71.400000000000006 110.84 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -131.93 139.14 48.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 72.040000000000006 110.894 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.494 HD21 ' CE2' ' A' ' 133' ' ' TYR . 3.7 mp -102.42 149.86 23.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 73.299999999999997 110.922 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 29.2 t -166.19 140.96 4.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 61.119999999999997 110.814 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.508 HG22 HG13 ' B' ' 317' ' ' VAL . 52.2 mt -115.59 -32.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.048 -0.524 . . . . 74.239999999999995 111.173 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.526 ' HA ' HG21 ' B' ' 317' ' ' VAL . 38.7 t0 -89.7 1.05 56.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 72.120000000000005 110.92 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 60.41 18.18 7.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 71.0 110.795 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -132.29 -38.43 1.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 72.209999999999994 110.88 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.4 t -103.06 104.54 16.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 44.340000000000003 111.132 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -99.88 144.69 28.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 62.009999999999998 110.933 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' PHE . . . . . 0.531 ' CD1' HD12 ' A' ' 152' ' ' LEU . 54.8 m-85 -118.64 178.42 4.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 74.140000000000001 110.924 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -100.19 -16.22 17.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 75.230000000000004 110.917 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -164.81 171.65 13.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.111 -0.495 . . . . 71.230000000000004 110.874 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.459 HD12 ' H ' ' A' ' 149' ' ' LEU . 0.7 OUTLIER -74.63 -22.37 58.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 64.209999999999994 110.949 179.966 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.2 ttp -63.67 -56.96 11.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 73.430000000000007 110.876 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.82 -36.3 83.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.289 -0.414 . . . . 74.319999999999993 110.885 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.531 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.68 -47.58 76.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.198 -0.455 . . . . 73.530000000000001 110.916 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.478 HG13 HD12 ' A' ' 167' ' ' LEU . 70.7 t -65.29 -37.49 80.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 73.129999999999995 111.14 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -55.53 -38.76 69.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.134 -0.485 . . . . 64.409999999999997 110.926 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -45.29 61.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 75.430000000000007 110.891 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.415 ' CD1' HD23 ' A' ' 163' ' ' LEU . 27.9 m-85 -67.5 -22.17 65.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 74.140000000000001 110.962 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 63.6 m -84.32 -29.62 26.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.105 -0.498 . . . . 43.009999999999998 111.088 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 92.6 m -78.13 -26.94 48.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 75.209999999999994 111.15 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.09 160.8 30.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 62.240000000000002 110.85 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.81 -58.28 6.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 63.329999999999998 111.068 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 6.0 t0 57.12 23.58 8.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 73.129999999999995 110.947 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.29 -0.64 25.2 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.721 -0.752 . . . . 32.420000000000002 112.498 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.638 HD13 ' CZ ' ' A' ' 129' ' ' TYR . 4.0 mm? -93.28 140.08 29.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.942 0.401 . . . . 60.439999999999998 110.855 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 44.3 t -51.33 -30.37 18.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 52.420000000000002 110.871 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.8 t -158.96 127.34 5.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 70.329999999999998 111.137 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -51.35 140.59 16.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 71.400000000000006 110.868 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.478 HD12 HG13 ' A' ' 153' ' ' VAL . 8.6 mt -62.39 139.51 58.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 54.130000000000003 110.919 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.641 HD12 ' O ' ' A' ' 101' ' ' THR . 26.6 mt -126.94 -51.3 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.284 -0.416 . . . . 71.209999999999994 111.164 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -131.03 123.35 19.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.585 0.707 . . . . 73.109999999999999 110.951 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 135.43 30.44 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.711 2.274 . . . . 61.530000000000001 112.331 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.8 83.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.434 . . . . 75.219999999999999 110.886 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.7 m -64.32 136.8 25.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.296 -0.411 . . . . 72.120000000000005 111.165 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 70.109999999999999 110.824 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 1.7 mt . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.789 0.328 . . . . 61.409999999999997 110.868 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 40.0 t -84.83 88.68 7.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 72.5 110.832 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -76.08 149.61 37.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 74.349999999999994 110.972 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.57 129.17 17.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.117 -0.492 . . . . 55.240000000000002 110.932 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 298' ' ' SER . . . . . 0.59 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -94.13 163.05 13.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.286 -0.416 . . . . 63.219999999999999 110.862 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 10.6 mtt180 -63.8 -15.42 58.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 72.310000000000002 110.853 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -37.94 84.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 72.420000000000002 110.876 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -96.98 -14.96 21.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.107 -0.497 . . . . 65.329999999999998 110.794 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.544 ' HB2' HD11 ' B' ' 305' ' ' LEU . 14.9 m-20 -156.39 80.75 3.7 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.577 0.703 . . . . 75.140000000000001 110.85 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -6.01 17.6 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.693 2.262 . . . . 65.040000000000006 112.341 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.2 t -93.61 27.26 2.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 72.230000000000004 111.188 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' B' ' 302' ' ' ASP . 34.7 mt -103.9 136.89 42.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 72.239999999999995 110.875 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.579 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.1 t -102.16 170.05 8.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.164 -0.471 . . . . 72.400000000000006 111.139 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -49.67 -33.89 16.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 64.219999999999999 110.919 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -62.5 -48.44 79.54 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.162 -0.472 . . . . 62.329999999999998 110.9 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.579 ' HG2' HG22 ' B' ' 306' ' ' THR . 7.9 mm-40 -65.14 -51.72 59.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 72.219999999999999 110.92 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 27.4 mm -58.59 -53.77 42.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 75.150000000000006 111.089 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 26.8 t -58.01 -24.3 57.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 75.239999999999995 110.84 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -74.55 -5.67 44.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 51.25 111.069 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.256 -0.429 . . . . 72.200000000000003 110.879 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 3.9 t . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.791 0.329 . . . . 62.149999999999999 110.795 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.88 152.82 0.05 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 50.32 110.915 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.526 HG21 ' HA ' ' A' ' 141' ' ' ASP . 4.5 m -54.19 122.28 3.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.468 . . . . 71.129999999999995 111.096 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -132.95 74.88 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.069 -0.514 . . . . 74.099999999999994 110.919 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.352 0 CA-C-O 121.603 0.716 . . . . 61.130000000000003 110.932 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.694 0.206 . . . . 71.319999999999993 112.293 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.473 ' CH2' HG21 ' A' ' 153' ' ' VAL . 47.0 p-90 -54.82 -26.63 36.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 75.239999999999995 110.925 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -84.31 102.33 12.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 54.140000000000001 110.876 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 -76.39 -40.05 51.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 72.5 110.897 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.3 18.89 37.6 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.744 -0.741 . . . . 64.120000000000005 112.472 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -179.96 78.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.737 0.303 . . . . 74.310000000000002 110.864 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.5 mm -142.72 144.41 24.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 63.43 111.061 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.46 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -101.32 175.08 5.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.113 -0.494 . . . . 73.5 111.177 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.46 ' H ' HG22 ' A' ' 88' ' ' THR . 6.6 ttt180 -62.19 -42.71 99.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 75.150000000000006 110.883 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -68.34 -33.87 75.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.162 -0.472 . . . . 72.239999999999995 110.939 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -75.49 -41.78 54.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 74.319999999999993 110.922 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.48 -33.48 62.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.482 . . . . 55.119999999999997 111.129 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.448 ' OE2' HG21 ' A' ' 126' ' ' VAL . 20.3 mm-40 -63.4 -53.27 54.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.45 . . . . 75.329999999999998 110.922 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.18 -35.6 81.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.479 . . . . 74.129999999999995 110.832 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 16.7 mt -61.21 -35.82 78.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 55.409999999999997 110.892 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.669 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.5 mm? -102.96 43.12 1.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.19 -0.459 . . . . 63.329999999999998 110.878 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.495 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.18 -59.97 4.63 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.678 0.751 . . . . 72.040000000000006 110.907 179.996 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.9 Cg_endo -69.74 123.09 9.77 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.719 2.279 . . . . 65.400000000000006 112.323 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 118.21 5.54 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.665 2.243 . . . . 63.229999999999997 112.334 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -154.81 100.48 2.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.27 -0.423 . . . . 71.230000000000004 110.858 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.665 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.6 OUTLIER -53.46 111.76 0.77 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 74.25 111.146 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.81 -6.28 6.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.79 -0.719 . . . . 63.340000000000003 112.504 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.28 111.75 23.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.808 0.337 . . . . 73.120000000000005 110.916 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -124.54 162.06 24.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 73.310000000000002 110.89 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.578 HD23 HD21 ' A' ' 96' ' ' LEU . 0.7 OUTLIER -158.37 138.67 12.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 44.340000000000003 110.873 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.838 HG22 HD22 ' A' ' 118' ' ' LEU . 79.9 t -110.16 137.73 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 64.219999999999999 111.145 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -149.8 143.39 25.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.212 -0.449 . . . . 75.540000000000006 110.882 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -50.24 123.78 9.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.447 . . . . 75.530000000000001 110.823 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 m -57.56 115.79 2.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.456 . . . . 72.230000000000004 110.86 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.617 HG21 ' HB2' ' B' ' 298' ' ' SER . 2.2 m -68.57 -56.39 8.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 61.340000000000003 111.133 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.619 ' CG ' HD12 ' B' ' 310' ' ' ILE . 4.3 m-80 -69.28 -26.62 64.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 71.430000000000007 110.921 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.407 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 2.7 m-85 -112.28 94.46 26.62 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.632 0.729 . . . . 70.140000000000001 110.939 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.5 Cg_endo -69.77 112.26 3.03 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.663 2.242 . . . . 55.450000000000003 112.384 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.77 3.29 23.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.743 -0.741 . . . . 74.219999999999999 112.434 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -131.05 -176.06 3.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.816 0.341 . . . . 65.010000000000005 110.907 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -131.67 165.58 23.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 74.310000000000002 110.929 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 99.1 m -126.56 141.61 51.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.086 -0.506 . . . . 72.310000000000002 111.184 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.838 HD22 HG22 ' A' ' 106' ' ' VAL . 0.0 OUTLIER -109.16 106.32 16.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.279 -0.418 . . . . 75.329999999999998 110.885 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.6 m -98.99 118.69 36.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.47 . . . . 60.450000000000003 110.911 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.4 t -124.36 150.41 29.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 72.230000000000004 111.045 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.669 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -103.95 112.36 25.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 71.450000000000003 110.941 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.6 97.58 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.07 -0.514 . . . . 72.329999999999998 110.849 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 65.74 27.61 11.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 74.230000000000004 110.884 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.75 -13.38 63.92 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.752 -0.737 . . . . 72.230000000000004 112.498 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -88.38 140.3 29.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.764 0.316 . . . . 70.450000000000003 110.936 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.59 ' O ' HD13 ' B' ' 294' ' ' LEU . 11.2 m -100.47 111.37 29.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 70.200000000000003 111.13 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.454 ' OE2' HD11 ' B' ' 294' ' ' LEU . 2.7 mm-40 -99.68 124.84 45.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 75.230000000000004 110.89 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 61.1 m-70 -103.39 124.0 47.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 61.450000000000003 110.873 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.523 ' HB3' HD13 ' A' ' 140' ' ' ILE . 88.5 m-85 -114.67 100.24 8.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 72.319999999999993 110.964 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -55.54 131.76 46.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 74.340000000000003 110.834 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.819 HD11 HD23 ' A' ' 118' ' ' LEU . 38.2 mt -110.45 109.63 29.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 72.230000000000004 111.133 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.76 129.08 34.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.109999999999999 110.924 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.46 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.97 100.71 8.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.271 -0.422 . . . . 63.119999999999997 110.974 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -134.68 142.43 46.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 74.430000000000007 110.913 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 57.38 36.13 26.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 63.409999999999997 111.058 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.7 t 61.04 27.46 17.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 64.299999999999997 110.858 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 2.7 mtmm -133.21 145.34 50.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.136 -0.484 . . . . 75.409999999999997 110.82 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.46 HD21 ' CE2' ' A' ' 133' ' ' TYR . 1.6 mp -106.22 150.8 25.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 71.019999999999996 110.909 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.9 t -169.62 140.8 2.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 74.120000000000005 110.862 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.526 HD11 HG12 ' A' ' 131' ' ' ILE . 59.7 mt -115.51 -26.19 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 61.130000000000003 111.175 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.689 ' HB3' HG21 ' B' ' 317' ' ' VAL . 5.9 p30 -96.67 -2.48 44.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 53.520000000000003 110.884 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 61.94 16.75 8.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 63.020000000000003 110.882 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -127.36 -34.07 2.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 72.329999999999998 110.894 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.4 t -111.86 104.75 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 64.010000000000005 111.127 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -98.33 143.44 28.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.47 . . . . 75.329999999999998 110.931 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' PHE . . . . . 0.44 ' CD1' HD12 ' A' ' 152' ' ' LEU . 48.4 m-85 -117.51 171.53 7.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.083 -0.508 . . . . 74.109999999999999 110.862 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.68 -18.95 24.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.193 -0.458 . . . . 75.530000000000001 110.861 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.508 ' OD1' HD12 ' A' ' 149' ' ' LEU . 45.6 t30 -171.24 158.84 5.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 75.200000000000003 110.905 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.508 HD12 ' OD1' ' A' ' 148' ' ' ASN . 2.4 mp -51.36 -36.88 45.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 72.140000000000001 110.961 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.4 ttp -51.87 -48.87 63.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 74.5 110.939 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.99 -41.67 77.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 71.450000000000003 110.943 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.44 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.5 OUTLIER -56.0 -50.55 70.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 51.399999999999999 110.906 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.473 HG21 ' CH2' ' A' ' 82' ' ' TRP . 91.4 t -59.02 -43.67 89.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 72.310000000000002 111.141 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.78 -39.51 71.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 72.319999999999993 110.896 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.75 -50.74 48.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 71.340000000000003 110.842 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.424 ' CD1' HD13 ' A' ' 163' ' ' LEU . 38.2 m-85 -65.46 -19.63 66.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.469 . . . . 74.200000000000003 110.934 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.475 ' OG1' HD12 ' A' ' 167' ' ' LEU . 97.3 m -84.24 -28.77 27.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.13 -0.486 . . . . 74.310000000000002 111.041 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 27.2 m -81.92 -24.4 35.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.331 -0.395 . . . . 71.329999999999998 111.148 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -161.7 162.25 29.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 64.150000000000006 110.874 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.46 -58.1 7.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.207 -0.451 . . . . 64.150000000000006 111.0 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.76 20.5 10.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 75.420000000000002 110.911 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 112.3 13.53 11.83 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 14.5 112.483 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.424 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.6 mp -108.75 138.41 45.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.85 0.357 . . . . 75.230000000000004 110.936 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 31.6 t -51.66 -31.17 24.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 74.109999999999999 110.901 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 7.2 t -153.99 124.17 6.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.141 -0.481 . . . . 62.009999999999998 111.15 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -51.88 156.08 1.59 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 65.200000000000003 110.845 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.475 HD12 ' OG1' ' A' ' 157' ' ' THR . 7.7 mt -72.51 134.93 45.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 72.030000000000001 110.947 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.665 HD12 ' O ' ' A' ' 101' ' ' THR . 24.6 mt -127.03 -51.11 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.191 -0.459 . . . . 73.120000000000005 111.179 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -127.55 121.13 22.18 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.534 0.683 . . . . 74.099999999999994 110.866 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 135.13 29.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.694 2.263 . . . . 65.400000000000006 112.349 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.66 84.04 0.44 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 73.109999999999999 110.914 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 22.0 t -64.42 131.42 30.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 72.310000000000002 111.099 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 33.3 mtp . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 75.430000000000007 110.881 179.91 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.59 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.812 0.339 . . . . 74.219999999999999 110.888 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 2.2 m -113.59 89.03 2.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 64.209999999999994 110.866 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -72.32 148.26 45.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.51 . . . . 75.230000000000004 110.896 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -143.12 129.08 19.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.089 -0.505 . . . . 74.530000000000001 110.879 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 298' ' ' SER . . . . . 0.617 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -92.04 158.77 16.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.232 -0.44 . . . . 72.140000000000001 110.781 -179.862 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -59.76 -19.01 47.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 73.430000000000007 110.817 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -37.2 86.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 71.400000000000006 110.887 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -96.59 -17.6 20.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 74.439999999999998 110.872 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -155.05 79.92 4.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.583 0.706 . . . . 71.219999999999999 110.843 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -5.69 16.79 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.654 2.236 . . . . 62.100000000000001 112.353 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.4 t -92.68 27.53 2.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 73.420000000000002 111.132 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 23.8 mt -102.01 136.79 41.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.424 . . . . 72.329999999999998 110.922 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.642 HG22 ' HG2' ' B' ' 309' ' ' GLU . 12.1 t -105.98 174.84 5.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 74.400000000000006 111.151 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -49.6 -37.97 29.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 72.420000000000002 110.868 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.61 -51.83 66.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.149 -0.478 . . . . 74.230000000000004 110.846 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.642 ' HG2' HG22 ' B' ' 306' ' ' THR . 20.5 mm-40 -63.43 -52.08 63.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 74.049999999999997 110.909 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.619 HD12 ' CG ' ' A' ' 111' ' ' ASN . 43.1 mm -56.83 -53.78 37.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 72.120000000000005 111.1 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 26.3 t -58.85 -22.44 58.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.441 . . . . 63.240000000000002 110.868 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.53 4.13 25.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 74.340000000000003 111.065 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.236 -0.438 . . . . 74.420000000000002 110.863 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 CA--C 1.526 0.058 0 CA-C-O 120.959 0.409 . . . . 72.450000000000003 110.903 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 64.74 153.66 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.049 -0.523 . . . . 70.230000000000004 110.822 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.689 HG21 ' HB3' ' A' ' 141' ' ' ASP . 4.6 m -52.56 126.34 8.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.097 -0.501 . . . . 54.130000000000003 111.135 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -136.61 77.47 1.65 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 75.420000000000002 110.939 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? . . . . . 0 C--N 1.33 -0.277 0 CA-C-O 121.511 0.672 . . . . 73.120000000000005 110.95 179.914 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 N--CA 1.466 -0.113 0 CA-C-O 120.829 0.262 . . . . 62.32 112.402 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.469 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 35.1 p-90 -101.25 -29.41 12.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 74.329999999999998 110.897 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -90.3 106.58 18.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.278 -0.419 . . . . 72.510000000000005 110.939 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -83.63 -41.81 17.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 75.439999999999998 110.839 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 52.14 34.48 39.77 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.703 -0.761 . . . . 55.109999999999999 112.477 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.17 34.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.776 0.322 . . . . 64.200000000000003 110.864 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.7 mm -102.69 144.2 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 55.219999999999999 111.153 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.06 157.43 17.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 75.099999999999994 111.108 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.3 ppt_? -52.94 -36.95 60.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 74.409999999999997 110.896 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.2 -32.08 55.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 75.219999999999999 110.886 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -72.88 -35.23 67.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 74.129999999999995 110.929 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.99 -34.78 59.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 70.239999999999995 111.092 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -63.3 -52.69 60.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 72.239999999999995 110.863 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -39.51 94.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 71.430000000000007 110.811 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.3 mt -54.99 -39.34 68.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.276 -0.42 . . . . 73.409999999999997 110.943 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.639 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -99.01 43.38 1.06 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 74.019999999999996 110.904 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.494 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.42 -59.92 5.43 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.711 0.767 . . . . 71.219999999999999 110.926 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.69 123.41 10.1 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.719 2.279 . . . . 75.109999999999999 112.418 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 117.53 5.13 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.659 2.239 . . . . 64.25 112.379 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -154.75 112.34 3.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.455 . . . . 70.430000000000007 110.965 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.667 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.7 OUTLIER -63.92 111.73 2.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.466 . . . . 70.120000000000005 111.209 -179.9 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.95 -6.2 6.1 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.713 -0.756 . . . . 42.439999999999998 112.463 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.405 HD12 ' O ' ' A' ' 169' ' ' LYS . 2.4 tp -90.94 113.99 26.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.824 0.345 . . . . 72.099999999999994 110.922 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.444 ' HB3' HD22 ' A' ' 167' ' ' LEU . 18.9 p90 -125.55 166.09 17.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.141 -0.481 . . . . 62.340000000000003 110.863 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.556 HD23 HD21 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -163.93 138.33 5.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.151 -0.477 . . . . 64.420000000000002 110.907 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.469 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 90.5 t -110.37 128.22 66.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 42.119999999999997 111.141 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 145.13 42.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 71.230000000000004 110.821 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.62 127.15 19.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 63.130000000000003 110.864 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.8 m -61.82 113.34 2.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 52.329999999999998 110.87 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.543 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.8 m -69.31 -55.99 8.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.487 . . . . 52.420000000000002 111.083 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.63 ' CG ' HD12 ' B' ' 310' ' ' ILE . 42.4 m-80 -63.57 -28.97 70.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 73.219999999999999 110.888 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.427 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 33.8 m-85 -119.76 96.94 49.76 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.757 0.789 . . . . 64.420000000000002 110.94 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.7 Cg_endo -69.77 119.15 6.15 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.672 2.248 . . . . 62.520000000000003 112.375 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.73 -12.82 22.76 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.727 . . . . 71.319999999999993 112.499 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -114.26 -178.55 3.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.807 0.337 . . . . 75.030000000000001 110.85 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -131.05 160.21 35.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 62.32 110.964 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 58.8 m -133.36 131.85 40.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 73.549999999999997 111.12 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.445 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.3 OUTLIER -100.98 121.39 41.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 63.539999999999999 110.836 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.3 m -105.36 126.18 51.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.109 -0.496 . . . . 72.0 110.918 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.445 ' CG2' HD21 ' A' ' 118' ' ' LEU . 16.1 t -126.0 151.89 32.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.174 -0.466 . . . . 74.430000000000007 111.079 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.639 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.47 111.72 24.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 73.340000000000003 110.874 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.7 93.27 4.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.143 -0.481 . . . . 63.25 110.839 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 66.19 29.72 9.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 71.319999999999993 110.962 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.99 -13.42 63.54 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.715 -0.755 . . . . 40.200000000000003 112.525 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.2 ptpt -88.3 139.25 30.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.33 . . . . 72.420000000000002 110.884 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.602 ' O ' HD13 ' B' ' 294' ' ' LEU . 94.0 t -99.66 104.69 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 71.040000000000006 111.169 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -92.81 122.06 34.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 54.509999999999998 110.918 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -100.84 124.85 47.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.13 -0.486 . . . . 72.409999999999997 110.85 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -111.9 118.69 36.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.22 -0.445 . . . . 63.509999999999998 110.937 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -68.16 134.99 51.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 72.200000000000003 110.87 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.47 ' CG2' HD23 ' A' ' 138' ' ' LEU . 53.2 mt -117.59 109.59 28.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.476 . . . . 74.019999999999996 111.15 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.8 129.18 34.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 73.120000000000005 110.894 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.461 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.64 98.99 7.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 72.209999999999994 110.89 -179.822 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -130.94 142.44 50.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 73.340000000000003 110.908 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.12 36.77 27.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 72.239999999999995 111.07 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.26 23.95 14.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 73.109999999999999 110.817 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 3.8 mtmt -128.93 140.48 51.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.164 -0.471 . . . . 72.530000000000001 110.947 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.47 HD23 ' CG2' ' A' ' 131' ' ' ILE . 2.8 mp -101.73 151.93 21.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 72.319999999999993 110.945 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 39.6 t -168.43 142.22 3.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 74.420000000000002 110.874 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.443 HG22 HG13 ' B' ' 317' ' ' VAL . 52.6 mt -115.54 -40.83 3.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 72.319999999999993 111.125 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.703 ' HB3' HG21 ' B' ' 317' ' ' VAL . 38.1 p-10 -88.0 -1.04 57.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 61.020000000000003 110.93 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 59.6 20.04 8.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 65.430000000000007 110.877 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -123.23 -35.61 2.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 65.120000000000005 110.779 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.454 HG12 ' OD2' ' A' ' 141' ' ' ASP . 2.6 p -119.11 105.02 16.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 71.439999999999998 111.056 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -92.92 153.93 18.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 75.450000000000003 110.896 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -124.3 174.23 7.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 73.140000000000001 110.936 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.76 -17.91 21.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.010000000000005 110.849 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -171.82 158.85 5.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.478 . . . . 63.020000000000003 110.899 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.86 -36.02 46.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 64.430000000000007 110.9 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 2.6 ttt -53.03 -49.55 66.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 73.340000000000003 110.946 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.84 -39.69 83.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 71.230000000000004 110.948 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.9 -51.63 66.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 70.230000000000004 110.928 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.569 HG13 HD12 ' A' ' 167' ' ' LEU . 98.8 t -59.72 -42.85 90.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.230000000000004 111.078 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -54.39 -37.77 65.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 63.310000000000002 110.831 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -50.42 28.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 63.240000000000002 110.813 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.559 ' CD1' HD13 ' A' ' 163' ' ' LEU . 48.6 m-85 -66.49 -14.6 62.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 75.319999999999993 110.895 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 81.7 m -88.73 -32.35 17.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 70.230000000000004 111.119 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.9 m -80.27 -22.55 41.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 62.130000000000003 111.19 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -161.89 161.96 29.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 73.430000000000007 110.892 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.94 -58.07 6.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 73.120000000000005 111.124 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.87 18.45 10.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.468 . . . . 74.209999999999994 110.836 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.57 3.59 27.05 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.701 -0.761 . . . . 44.549999999999997 112.484 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.559 HD13 ' CD1' ' A' ' 156' ' ' TYR . 7.2 mp -95.61 138.63 33.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.85 0.357 . . . . 71.200000000000003 110.986 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 41.0 t -51.52 -29.87 18.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 73.530000000000001 110.948 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.7 t -156.17 122.76 5.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 74.400000000000006 111.101 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -51.28 147.36 5.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 63.240000000000002 110.898 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.569 HD12 HG13 ' A' ' 153' ' ' VAL . 6.8 mt -65.78 133.86 51.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 73.519999999999996 110.987 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.667 HD12 ' O ' ' A' ' 101' ' ' THR . 28.1 mt -127.12 -51.32 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 74.140000000000001 111.153 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 169' ' ' LYS . . . . . 0.405 ' O ' HD12 ' A' ' 103' ' ' LEU . 6.0 mtpm? -126.67 118.38 22.71 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.481 0.657 . . . . 75.230000000000004 110.961 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.68 139.95 41.79 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.689 2.26 . . . . 51.5 112.36 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 171' ' ' LYS . . . . . 0.404 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -70.07 82.94 0.51 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 73.310000000000002 110.912 179.876 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 15.8 m -64.81 125.99 22.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.278 -0.419 . . . . 71.319999999999993 111.171 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 30.3 mtp . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 72.540000000000006 110.847 179.969 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.602 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.3 OUTLIER . . . . . 0 CA--C 1.526 0.041 0 CA-C-O 120.857 0.36 . . . . 75.299999999999997 110.868 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 12.2 t -119.99 88.33 2.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 75.349999999999994 110.912 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -75.09 149.25 39.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 64.049999999999997 110.881 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.98 129.14 19.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.097 -0.501 . . . . 65.310000000000002 110.911 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 298' ' ' SER . . . . . 0.543 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -91.42 163.62 14.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 63.119999999999997 110.851 -179.844 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -64.06 -14.98 58.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.074 -0.512 . . . . 74.0 110.86 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -37.34 79.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 53.119999999999997 110.86 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -98.11 -18.21 18.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.103 -0.499 . . . . 74.099999999999994 110.893 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.432 ' HB2' HD11 ' B' ' 305' ' ' LEU . 8.0 m-20 -151.47 78.06 7.1 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.65 0.738 . . . . 75.239999999999995 110.923 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -5.95 17.39 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.681 2.254 . . . . 73.319999999999993 112.382 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.6 t -93.32 27.5 2.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 74.140000000000001 111.113 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' B' ' 302' ' ' ASP . 31.3 mt -101.45 136.82 40.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 54.100000000000001 110.894 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.645 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -106.03 173.55 6.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 55.130000000000003 111.09 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -49.4 -37.77 26.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 71.109999999999999 110.873 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -60.91 -53.02 62.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 53.229999999999997 110.912 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.645 ' HG2' HG22 ' B' ' 306' ' ' THR . 15.0 mm-40 -62.93 -52.44 63.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.195 -0.457 . . . . 74.540000000000006 110.91 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.63 HD12 ' CG ' ' A' ' 111' ' ' ASN . 41.9 mm -55.9 -53.92 32.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.11 -0.496 . . . . 75.400000000000006 111.154 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 60.5 p -58.71 -21.8 55.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 75.420000000000002 110.86 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.23 4.09 24.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 55.210000000000001 111.101 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 313' ' ' MET . . . . . 0.573 ' HE2' HD13 ' B' ' 310' ' ' ILE . 1.9 mtm . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.458 . . . . 53.439999999999998 110.935 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 11.6 t . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.803 0.335 . . . . 64.319999999999993 110.779 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.77 132.67 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.465 . . . . 60.409999999999997 110.806 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.703 HG21 ' HB3' ' A' ' 141' ' ' ASP . 20.7 m -52.47 125.64 6.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.042 -0.527 . . . . 71.430000000000007 111.13 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -130.59 76.34 1.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 75.310000000000002 110.841 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 30.4 mttt . . . . . 0 C--N 1.329 -0.297 0 CA-C-O 121.601 0.715 . . . . 74.299999999999997 110.859 179.87 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 N--CA 1.465 -0.179 0 CA-C-O 120.767 0.236 . . . . 73.049999999999997 112.347 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.476 ' CH2' HG21 ' A' ' 153' ' ' VAL . 42.9 p-90 -99.98 -29.81 12.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.221 -0.445 . . . . 74.420000000000002 110.832 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -85.78 99.3 11.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.261 -0.427 . . . . 65.230000000000004 110.895 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.7 m80 -75.88 -37.0 59.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 62.420000000000002 110.796 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.61 19.61 35.52 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.722 -0.752 . . . . 43.520000000000003 112.509 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.65 80.51 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.7 0.286 . . . . 53.549999999999997 110.82 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.589 HG23 ' HB3' ' A' ' 91' ' ' GLN . 27.2 mm -145.12 144.99 21.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.277 -0.419 . . . . 61.409999999999997 111.175 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.3 p -100.38 177.09 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.214 -0.448 . . . . 64.299999999999997 111.216 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 64.1 ttt-85 -63.75 -41.22 98.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 62.149999999999999 110.858 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.36 -36.79 83.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.435 . . . . 74.450000000000003 110.914 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.589 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -75.25 -39.8 59.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 71.319999999999993 110.969 -179.938 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.46 -33.94 65.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 71.409999999999997 111.074 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -65.0 -53.34 47.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.445 . . . . 72.239999999999995 110.887 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -35.55 81.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.46 . . . . 74.230000000000004 110.891 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.55 -35.43 77.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 52.030000000000001 110.926 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.638 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -105.48 43.38 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.109999999999999 110.951 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.488 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.98 -60.21 4.56 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.748 0.785 . . . . 62.539999999999999 110.933 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.3 Cg_endo -69.79 123.64 10.29 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.663 2.242 . . . . 73.230000000000004 112.343 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.8 117.57 5.16 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.717 2.278 . . . . 71.239999999999995 112.392 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -154.72 110.3 3.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.191 -0.459 . . . . 74.209999999999994 110.889 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.664 ' O ' HD12 ' A' ' 168' ' ' ILE . 1.1 p -61.98 111.88 2.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 75.019999999999996 111.114 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.68 -6.88 6.2 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 73.129999999999995 112.491 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.439 HD21 ' HE3' ' A' ' 171' ' ' LYS . 2.7 tp -90.72 111.79 23.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.855 0.36 . . . . 74.099999999999994 110.859 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.418 ' HB3' HD22 ' A' ' 167' ' ' LEU . 18.9 p90 -123.12 167.63 13.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 73.420000000000002 110.879 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.576 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -163.39 137.13 5.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.114 -0.494 . . . . 73.209999999999994 110.883 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.44 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 90.1 t -110.4 135.16 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 74.349999999999994 111.143 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -149.1 140.51 23.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 53.350000000000001 110.888 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -50.96 124.01 10.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.437 . . . . 61.200000000000003 110.857 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.7 t -55.44 119.38 5.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 50.130000000000003 110.866 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 94.1 m -70.15 -56.15 7.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 71.120000000000005 111.111 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.42 -42.64 98.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.255 -0.43 . . . . 70.140000000000001 110.871 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -106.01 96.08 12.24 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.621 0.724 . . . . 74.420000000000002 110.923 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 122.21 8.88 Favored 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 122.647 2.232 . . . . 74.230000000000004 112.342 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.75 -9.64 23.57 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.757 -0.735 . . . . 74.230000000000004 112.479 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -118.64 176.89 5.05 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.768 0.318 . . . . 62.25 110.925 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -124.13 158.68 31.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.285 -0.416 . . . . 72.310000000000002 110.93 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.5 m -132.19 121.67 24.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 72.310000000000002 111.194 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.443 HD23 ' CD1' ' A' ' 129' ' ' TYR . 0.4 OUTLIER -95.01 116.84 29.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 73.239999999999995 110.916 179.974 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 1.8 t -102.33 125.53 49.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.278 -0.419 . . . . 53.039999999999999 110.811 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.1 t -125.68 151.39 31.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 63.119999999999997 111.141 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.638 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.06 112.07 24.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.476 . . . . 75.530000000000001 110.843 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.55 94.36 4.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 75.230000000000004 110.904 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 66.56 29.15 9.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.329999999999998 110.925 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 98.0 -14.3 62.79 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.7 -0.762 . . . . 72.120000000000005 112.523 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.88 139.65 30.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.806 0.336 . . . . 64.409999999999997 110.973 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.447 ' O ' HG23 ' A' ' 126' ' ' VAL . 6.2 m -98.84 99.68 9.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.289 -0.414 . . . . 73.530000000000001 111.157 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -86.67 123.75 32.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 73.239999999999995 110.915 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 53.6 m-70 -101.38 127.15 48.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.118 -0.492 . . . . 74.299999999999997 110.946 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.443 ' CD1' HD23 ' A' ' 118' ' ' LEU . 69.5 m-85 -113.48 106.23 14.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 71.430000000000007 110.933 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -58.26 137.25 57.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 72.129999999999995 110.902 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.448 ' CG2' HD23 ' A' ' 138' ' ' LEU . 61.8 mt -117.97 107.31 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 74.150000000000006 111.163 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.77 126.68 31.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 73.329999999999998 110.874 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -113.88 114.62 26.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.456 . . . . 74.430000000000007 110.936 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -149.72 138.37 20.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.137 -0.483 . . . . 72.239999999999995 110.922 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 53.66 35.83 22.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 64.409999999999997 111.094 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.72 28.81 16.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 63.530000000000001 110.863 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -129.36 140.1 51.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 71.409999999999997 110.847 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.448 HD23 ' CG2' ' A' ' 131' ' ' ILE . 1.8 mp -105.51 147.22 28.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 61.399999999999999 110.883 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 28.0 t -164.45 139.17 5.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 73.019999999999996 110.874 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.43 HG22 HG13 ' B' ' 317' ' ' VAL . 46.2 mt -115.53 -40.85 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.145 -0.48 . . . . 60.109999999999999 111.152 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.483 ' HA ' HG21 ' B' ' 317' ' ' VAL . 20.7 p30 -83.86 -7.02 59.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 71.140000000000001 110.882 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 61.79 16.12 7.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.187 -0.46 . . . . 73.400000000000006 110.889 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -123.23 -11.29 7.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 71.030000000000001 110.916 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -143.07 104.36 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.156 -0.474 . . . . 63.340000000000003 111.118 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -92.58 144.68 25.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.230000000000004 110.885 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -115.17 175.37 5.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.096 -0.502 . . . . 74.540000000000006 110.868 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.34 -13.92 18.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 45.210000000000001 110.932 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -168.7 171.84 8.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 65.109999999999999 110.883 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 mp -73.87 -24.02 59.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 70.319999999999993 110.908 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -59.6 -56.89 16.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 74.510000000000005 110.889 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -68.08 -36.5 79.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 61.32 110.885 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.47 -52.98 61.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.245 -0.434 . . . . 72.340000000000003 110.968 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.476 HG21 ' CH2' ' A' ' 82' ' ' TRP . 56.9 t -62.61 -36.22 74.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.116 -0.493 . . . . 73.329999999999998 111.133 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -55.33 -39.49 70.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 74.450000000000003 110.883 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -71.89 -50.3 30.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 74.25 110.838 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -62.71 -22.32 66.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 74.040000000000006 110.95 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.654 ' OG1' HD12 ' A' ' 167' ' ' LEU . 89.1 m -86.38 -27.13 24.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 72.129999999999995 111.166 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 90.0 m -79.4 -23.66 43.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 74.400000000000006 111.095 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.76 165.45 23.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.249 -0.432 . . . . 64.239999999999995 110.892 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.27 -58.3 6.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.46 . . . . 40.420000000000002 111.101 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 58.65 21.38 8.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.119 -0.491 . . . . 70.340000000000003 110.814 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 106.75 16.69 13.39 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.692 -0.766 . . . . 73.430000000000007 112.465 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.6 mp -107.3 140.31 40.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.833 0.349 . . . . 64.319999999999993 110.933 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 48.6 t -51.78 -29.89 20.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 73.200000000000003 110.912 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.7 t -159.4 123.58 3.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 75.540000000000006 111.176 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.96 146.16 6.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 62.219999999999999 110.884 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.654 HD12 ' OG1' ' A' ' 157' ' ' THR . 7.3 mt -65.0 136.68 57.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 75.219999999999999 110.903 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.664 HD12 ' O ' ' A' ' 101' ' ' THR . 28.1 mt -127.06 -51.23 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.273 -0.421 . . . . 72.239999999999995 111.167 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.21 119.63 19.73 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.659 0.742 . . . . 72.340000000000003 110.851 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 140.76 43.39 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.73 2.287 . . . . 71.230000000000004 112.361 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 171' ' ' LYS . . . . . 0.439 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -70.67 82.72 0.61 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 72.530000000000001 110.891 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 26.8 m -64.89 129.03 28.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.411 . . . . 64.200000000000003 111.079 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.9 ptm . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 64.510000000000005 110.853 179.912 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.893 0.378 . . . . 72.209999999999994 110.911 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 9.4 t -123.03 88.07 2.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 74.209999999999994 110.795 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -76.19 149.06 37.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.107 -0.497 . . . . 73.549999999999997 110.937 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -158.2 129.73 6.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 70.420000000000002 110.884 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.13 175.83 5.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.245 -0.434 . . . . 44.32 110.873 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 26.5 mtt180 -64.48 -15.67 61.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 73.010000000000005 110.864 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -41.83 99.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 71.129999999999995 110.906 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -104.2 -10.38 17.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.099 -0.5 . . . . 52.149999999999999 110.937 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.529 ' HB2' HD11 ' B' ' 305' ' ' LEU . 7.1 m-20 -158.15 78.6 3.33 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.598 0.713 . . . . 75.510000000000005 110.872 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -6.12 17.81 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.697 2.264 . . . . 61.119999999999997 112.344 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.9 t -93.18 27.18 2.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.246 -0.434 . . . . 73.25 111.102 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.529 HD11 ' HB2' ' B' ' 302' ' ' ASP . 31.2 mt -105.1 137.97 42.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.436 . . . . 72.129999999999995 110.894 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.605 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -103.66 173.46 6.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 40.32 111.209 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -50.33 -32.83 18.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 110.918 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 308' ' ' GLU . . . . . 0.462 ' H ' HG23 ' B' ' 306' ' ' THR . 0.1 OUTLIER -65.83 -47.64 74.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 64.120000000000005 110.855 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.605 ' HG2' HG22 ' B' ' 306' ' ' THR . 20.5 mm-40 -67.42 -52.35 40.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 75.129999999999995 110.904 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 46.0 mm -55.94 -46.79 80.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 70.230000000000004 111.152 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 27.9 p -72.06 -17.03 62.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 74.329999999999998 110.855 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.39 2.42 32.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 61.43 111.17 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 61.43 110.902 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.859 0.362 . . . . 74.120000000000005 110.849 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 65.15 151.05 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 72.420000000000002 110.874 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.483 HG21 ' HA ' ' A' ' 141' ' ' ASP . 6.7 m -51.47 122.58 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 73.310000000000002 111.132 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -135.26 76.7 1.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 75.219999999999999 110.927 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? . . . . . 0 C--N 1.329 -0.317 0 CA-C-O 121.618 0.723 . . . . 73.209999999999994 110.877 179.934 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 C--O 1.231 0.172 0 CA-C-O 120.796 0.248 . . . . 54.009999999999998 112.378 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.564 ' CH2' HD12 ' A' ' 149' ' ' LEU . 46.2 p-90 -101.94 -29.37 11.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.030000000000001 110.898 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -85.59 99.56 11.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 75.129999999999995 110.818 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -75.88 -38.77 57.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 62.399999999999999 110.831 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.34 20.66 45.25 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.736 -0.745 . . . . 41.329999999999998 112.502 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 179.38 66.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 64.299999999999997 110.932 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.555 HG21 ' HB2' ' A' ' 92' ' ' ALA . 7.3 mm -129.58 144.74 37.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.443 . . . . 75.409999999999997 111.106 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.447 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -95.33 176.98 5.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.19 -0.459 . . . . 73.209999999999994 111.144 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.447 ' H ' HG22 ' A' ' 88' ' ' THR . 0.0 OUTLIER -66.67 -38.25 86.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.239999999999995 110.858 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.87 -33.63 62.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.445 . . . . 61.210000000000001 110.847 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 8.6 mm100 -73.54 -41.33 63.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.239999999999995 110.832 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.555 ' HB2' HG21 ' A' ' 87' ' ' ILE . . . -75.32 -33.65 61.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 74.519999999999996 111.097 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -62.16 -53.47 54.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 73.230000000000004 110.863 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -38.49 91.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.120000000000005 110.892 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 92' ' ' ALA . 15.5 mt -54.99 -38.91 68.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.181 -0.463 . . . . 75.510000000000005 110.905 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.594 HD12 ' CB ' ' A' ' 121' ' ' SER . 1.6 mm? -101.26 43.7 1.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 72.310000000000002 110.892 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.5 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -66.89 -59.46 7.72 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.656 0.741 . . . . 72.439999999999998 110.978 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.81 123.11 9.76 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.697 2.264 . . . . 74.5 112.312 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 119.1 6.1 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.683 2.255 . . . . 61.439999999999998 112.34 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -155.09 108.99 2.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 74.310000000000002 110.95 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.663 ' O ' HD12 ' A' ' 168' ' ' ILE . 1.0 OUTLIER -60.92 117.17 5.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 62.399999999999999 111.153 -179.902 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 123.83 -6.49 8.96 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.734 -0.746 . . . . 53.310000000000002 112.493 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 tp -91.2 116.02 28.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 64.239999999999995 110.869 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.601 ' HB3' HD22 ' A' ' 167' ' ' LEU . 14.9 p90 -128.25 163.38 24.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 72.209999999999994 110.866 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.556 HD23 HD21 ' A' ' 96' ' ' LEU . 1.1 pp -161.18 134.83 6.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.494 . . . . 74.230000000000004 110.886 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 87.0 t -109.65 136.03 46.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 73.120000000000005 111.133 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -147.13 144.24 28.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 64.519999999999996 110.874 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -51.66 124.19 11.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.471 . . . . 73.150000000000006 110.88 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 m -57.22 116.05 3.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 63.030000000000001 110.806 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 78.8 m -69.31 -56.39 7.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.103 -0.499 . . . . 71.129999999999995 111.115 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.433 ' OD1' HG21 ' B' ' 310' ' ' ILE . 21.3 p30 -71.7 -26.57 62.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.238 -0.437 . . . . 72.230000000000004 110.866 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.71 90.24 7.23 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.768 0.794 . . . . 72.010000000000005 110.886 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 112.32 3.05 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.671 2.247 . . . . 61.299999999999997 112.336 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.58 6.0 21.95 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.718 -0.753 . . . . 54.409999999999997 112.502 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -136.16 178.76 6.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.829 0.347 . . . . 71.25 110.871 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 99.2 m-85 -128.58 160.48 32.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.446 . . . . 75.129999999999995 110.948 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 93.4 m -131.68 140.27 49.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 52.439999999999998 111.137 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.403 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.3 OUTLIER -112.13 120.59 42.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 72.530000000000001 110.859 179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 3.8 t -103.36 126.19 50.39 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.144 -0.48 . . . . 75.049999999999997 110.923 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.403 ' CG2' HD21 ' A' ' 118' ' ' LEU . 19.3 t -128.06 146.3 33.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 72.540000000000006 111.107 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.594 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -99.41 110.43 22.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 34.420000000000002 110.896 -179.899 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.49 94.05 4.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.135 -0.484 . . . . 72.219999999999999 110.913 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 66.92 28.81 8.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 74.219999999999999 110.828 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.75 -16.22 60.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.732 -0.747 . . . . 44.130000000000003 112.503 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -87.99 139.78 30.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.839 0.352 . . . . 71.230000000000004 110.888 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.437 ' O ' HG23 ' A' ' 126' ' ' VAL . 11.4 m -98.06 110.3 25.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 74.019999999999996 111.117 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -97.03 113.62 25.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 72.519999999999996 110.828 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -90.77 124.76 35.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 64.219999999999999 110.848 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.615 ' CE1' HD13 ' A' ' 163' ' ' LEU . 58.3 m-85 -115.54 108.93 17.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 71.219999999999999 110.935 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.02 142.54 58.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.14 -0.482 . . . . 73.549999999999997 110.834 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.454 HG22 HD23 ' A' ' 138' ' ' LEU . 30.8 mt -122.59 111.66 31.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.215 -0.448 . . . . 64.510000000000005 111.152 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -84.1 130.11 34.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 72.230000000000004 110.833 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.459 ' CE2' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.32 100.75 8.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 73.25 110.92 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -134.4 142.57 47.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 74.150000000000006 110.852 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.9 37.69 28.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.129 -0.487 . . . . 62.009999999999998 111.08 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.73 31.59 21.33 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.983 0.421 . . . . 71.129999999999995 110.89 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 4.0 mtmm -138.41 143.34 39.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.099 -0.5 . . . . 74.510000000000005 110.83 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.608 HD22 HD22 ' A' ' 149' ' ' LEU . 1.4 mp -104.25 151.67 23.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.25 110.953 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -169.4 144.99 3.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.238 -0.437 . . . . 72.140000000000001 110.839 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.413 HG22 HG13 ' B' ' 317' ' ' VAL . 47.8 mt -115.61 -37.83 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.103 -0.499 . . . . 74.129999999999995 111.122 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.499 ' HB3' HG11 ' B' ' 317' ' ' VAL . 9.8 p30 -88.77 -0.3 57.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 72.430000000000007 110.896 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 60.93 17.35 7.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.23 -0.441 . . . . 73.420000000000002 110.905 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -125.27 -32.48 2.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 71.400000000000006 110.864 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -113.65 104.62 17.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 71.510000000000005 111.081 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -97.74 143.86 27.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 74.340000000000003 110.97 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -119.06 175.18 5.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.05 -0.523 . . . . 71.310000000000002 110.886 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.05 -16.38 20.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 74.140000000000001 110.912 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -172.49 159.71 4.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 65.530000000000001 110.895 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.608 HD22 HD22 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -52.21 -39.19 59.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 71.299999999999997 110.978 179.916 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.8 ttt -51.03 -49.74 59.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 71.340000000000003 110.872 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.93 -39.85 87.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 64.200000000000003 110.941 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.07 -50.69 71.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 44.340000000000003 110.912 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.479 HG21 ' CH2' ' A' ' 82' ' ' TRP . 96.8 t -57.95 -44.24 86.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 74.109999999999999 111.108 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -53.27 -40.17 64.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 73.109999999999999 110.954 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -52.96 17.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.17 -0.468 . . . . 70.430000000000007 110.894 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.41 ' CE1' HD23 ' A' ' 163' ' ' LEU . 36.2 m-85 -62.27 -17.48 58.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 71.299999999999997 110.893 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.443 HG23 ' O ' ' A' ' 167' ' ' LEU . 80.9 m -85.91 -32.81 21.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 64.329999999999998 111.152 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 3.2 m -82.12 -16.3 50.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 75.040000000000006 111.154 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -177.38 131.85 0.17 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 74.409999999999997 110.872 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 160' ' ' ALA . . . . . 0.41 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -50.3 -58.45 5.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 65.340000000000003 111.077 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 50.86 37.93 18.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 70.030000000000001 110.855 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 129.76 0.45 5.67 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.728 -0.748 . . . . 43.409999999999997 112.461 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.615 HD13 ' CE1' ' A' ' 129' ' ' TYR . 2.5 mm? -106.73 139.58 40.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.835 0.35 . . . . 45.140000000000001 110.975 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 53.7 t -56.79 -21.72 30.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 74.150000000000006 110.893 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.8 t -162.2 116.36 1.84 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.143 -0.48 . . . . 71.049999999999997 111.119 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.41 138.02 13.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 60.140000000000001 110.864 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.601 HD22 ' HB3' ' A' ' 104' ' ' PHE . 8.4 mt -61.34 126.71 28.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.441 . . . . 75.439999999999998 110.848 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.663 HD12 ' O ' ' A' ' 101' ' ' THR . 51.3 mt -109.71 -51.49 6.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 75.400000000000006 111.112 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 169' ' ' LYS . . . . . 0.412 ' HE3' HG22 ' A' ' 168' ' ' ILE . 3.8 mtmp? -136.77 139.71 29.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.562 0.696 . . . . 75.140000000000001 110.858 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.82 139.46 40.08 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.631 2.221 . . . . 61.219999999999999 112.276 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.54 84.3 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 74.120000000000005 110.885 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 29.2 m -63.95 131.01 29.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 64.140000000000001 111.106 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.5 ptt? . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 64.299999999999997 110.923 179.841 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.821 0.343 . . . . 63.549999999999997 110.889 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 10.3 t -101.71 87.87 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 65.340000000000003 110.902 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -83.53 119.53 24.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 74.219999999999999 110.863 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -120.72 128.52 53.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 75.219999999999999 110.939 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.22 172.63 8.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 64.129999999999995 110.913 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 51.3 mtt180 -62.52 -16.41 55.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 74.409999999999997 110.838 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -37.78 84.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 64.010000000000005 110.893 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -104.01 -23.9 13.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 73.519999999999996 110.854 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.435 ' HB2' HD11 ' B' ' 305' ' ' LEU . 3.6 m-20 -143.28 78.89 14.57 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.619 0.723 . . . . 73.319999999999993 110.857 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -6.16 17.94 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.663 2.242 . . . . 70.209999999999994 112.35 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.7 t -93.64 27.58 2.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 64.299999999999997 111.119 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.435 HD11 ' HB2' ' B' ' 302' ' ' ASP . 36.8 mt -100.7 147.73 25.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 55.439999999999998 110.979 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.611 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.3 t -113.31 173.77 6.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 74.439999999999998 111.122 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -48.81 -36.91 17.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.204 -0.453 . . . . 65.540000000000006 110.9 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -62.45 -49.89 73.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 72.450000000000003 110.9 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.611 ' HG2' HG22 ' B' ' 306' ' ' THR . 18.5 mm-40 -64.12 -48.72 75.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 72.439999999999998 110.834 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.433 HG21 ' OD1' ' A' ' 111' ' ' ASN . 42.5 mm -61.94 -35.65 69.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 71.219999999999999 111.111 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 10.8 t -77.51 -15.71 59.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 64.340000000000003 110.813 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.41 3.62 27.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.135 -0.484 . . . . 72.129999999999995 111.082 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 313' ' ' MET . . . . . 0.426 ' HE3' ' HA ' ' B' ' 310' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 73.349999999999994 110.904 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.938 0.399 . . . . 72.340000000000003 110.845 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 64.16 156.77 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 74.310000000000002 110.818 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 141' ' ' ASP . 6.0 m -50.86 118.62 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 74.099999999999994 111.092 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -136.75 85.34 2.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.471 . . . . 72.329999999999998 110.866 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 14.6 mttt . . . . . 0 C--N 1.329 -0.313 0 CA-C-O 121.519 0.676 . . . . 70.120000000000005 110.94 179.892 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 C--O 1.231 0.174 0 CA-C-O 120.707 0.211 . . . . 52.520000000000003 112.334 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.546 ' CH2' HD12 ' A' ' 149' ' ' LEU . 56.1 p-90 -81.88 -18.79 42.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.218 -0.446 . . . . 74.340000000000003 110.911 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -97.59 99.28 10.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.44 . . . . 74.510000000000005 110.889 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -75.99 -39.48 55.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 73.310000000000002 110.871 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 56.84 22.25 40.3 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 74.540000000000006 112.508 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.21 69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.773 0.32 . . . . 61.340000000000003 110.886 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.403 HG21 ' HB2' ' A' ' 92' ' ' ALA . 11.6 mm -133.12 144.44 36.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 72.400000000000006 111.125 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.458 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -98.18 168.89 9.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.15 -0.477 . . . . 73.010000000000005 111.105 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.458 ' H ' HG22 ' A' ' 88' ' ' THR . 5.5 ptm180 -58.93 -39.49 81.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 74.540000000000006 110.9 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -71.37 -35.62 71.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 74.019999999999996 110.963 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -72.93 -40.47 65.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.072 -0.513 . . . . 60.310000000000002 110.96 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.403 ' HB2' HG21 ' A' ' 87' ' ' ILE . . . -75.63 -33.74 60.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 73.040000000000006 111.138 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -61.67 -53.09 60.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.244 -0.434 . . . . 75.530000000000001 110.845 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -38.21 90.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 73.439999999999998 110.89 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.1 mt -55.62 -38.07 69.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.479 . . . . 72.230000000000004 110.967 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.658 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -100.0 43.27 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 73.439999999999998 110.933 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.498 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.62 -59.87 5.27 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.686 0.755 . . . . 63.130000000000003 110.942 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.2 Cg_endo -69.77 123.56 10.22 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.705 2.27 . . . . 72.510000000000005 112.332 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 116.87 4.76 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.719 2.28 . . . . 61.43 112.37 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -154.98 109.33 2.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 62.329999999999998 110.9 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.688 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.2 OUTLIER -62.09 111.64 2.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 52.439999999999998 111.164 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 131.03 -9.21 5.71 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.797 -0.716 . . . . 60.32 112.514 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -87.32 111.65 21.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.873 0.368 . . . . 74.200000000000003 110.885 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -123.59 163.63 20.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 74.219999999999999 110.908 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.653 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -160.45 135.74 7.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.16 -0.473 . . . . 72.439999999999998 110.917 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 87.8 t -109.97 137.04 44.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.236 -0.438 . . . . 70.439999999999998 111.063 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.7 ptt180 -150.15 144.4 25.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 71.540000000000006 110.867 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -54.9 125.71 21.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.484 . . . . 61.420000000000002 110.863 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.96 116.57 2.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 62.020000000000003 110.795 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.5 m -69.95 -29.88 67.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 63.340000000000003 111.111 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -102.53 0.35 33.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 73.530000000000001 110.881 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.428 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -139.7 94.88 9.04 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.657 0.742 . . . . 71.200000000000003 110.965 -179.925 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.7 Cg_endo -69.79 113.02 3.24 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.673 2.249 . . . . 75.519999999999996 112.354 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.8 -8.87 23.64 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.718 -0.753 . . . . 53.140000000000001 112.418 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.09 163.97 15.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.833 0.349 . . . . 75.109999999999999 110.87 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -118.32 160.08 22.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 60.329999999999998 110.953 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.6 m -137.02 127.94 27.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 72.010000000000005 111.141 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.58 125.06 46.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 73.420000000000002 110.973 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 17.9 t -109.24 124.26 50.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.225 -0.443 . . . . 71.340000000000003 110.899 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.1 t -123.5 153.39 29.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.471 . . . . 73.349999999999994 111.121 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.658 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -104.93 112.49 25.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 44.310000000000002 110.879 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.78 94.59 4.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.457 . . . . 54.450000000000003 110.926 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 67.16 29.67 7.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 60.5 110.971 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.74 -14.1 63.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.747 -0.739 . . . . 74.099999999999994 112.514 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.69 141.05 28.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 73.409999999999997 110.876 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.666 ' O ' HD13 ' B' ' 294' ' ' LEU . 9.0 m -100.83 111.1 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 74.439999999999998 111.149 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -102.23 123.97 46.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 74.099999999999994 110.854 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -101.15 132.18 46.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 71.310000000000002 110.902 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -116.17 122.73 45.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 61.119999999999997 110.921 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.579 ' O ' HG23 ' A' ' 140' ' ' ILE . 14.1 tpt180 -72.17 136.02 46.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 71.209999999999994 110.909 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 54.1 mt -117.74 107.08 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 74.040000000000006 111.137 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -83.0 128.78 34.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.448 . . . . 71.400000000000006 110.896 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.464 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.1 OUTLIER -113.7 103.04 10.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.442 . . . . 73.040000000000006 110.917 -179.852 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -140.85 142.64 34.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 73.239999999999995 110.847 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.72 39.6 24.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 71.340000000000003 111.095 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 56.96 25.15 10.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 64.530000000000001 110.864 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.8 mtmm -132.0 152.75 50.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 75.540000000000006 110.874 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.464 HD21 ' CE2' ' A' ' 133' ' ' TYR . 1.1 mt -115.86 150.49 36.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.434 . . . . 72.5 110.92 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 7.9 t -168.4 145.35 3.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 71.349999999999994 110.852 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.579 HG23 ' O ' ' A' ' 130' ' ' ARG . 35.4 mt -115.61 -32.09 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 74.420000000000002 111.089 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.482 ' CB ' HG21 ' B' ' 317' ' ' VAL . 36.8 t0 -89.37 1.61 55.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 70.209999999999994 110.8 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 60.31 18.18 7.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 72.549999999999997 110.852 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -132.22 -38.81 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 74.129999999999995 110.931 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.3 t -100.73 104.72 16.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 54.439999999999998 111.156 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -100.84 141.11 34.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 74.209999999999994 110.946 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' PHE . . . . . 0.463 ' CD1' HD12 ' A' ' 152' ' ' LEU . 52.0 m-85 -116.66 173.97 6.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 72.340000000000003 110.85 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.28 -17.56 22.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.094 -0.503 . . . . 74.239999999999995 110.941 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -170.49 158.71 6.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.08 -0.509 . . . . 62.210000000000001 110.877 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.546 HD12 ' CH2' ' A' ' 82' ' ' TRP . 0.0 OUTLIER -53.05 -39.42 63.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 63.520000000000003 110.925 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.9 ttt -51.29 -47.92 62.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 72.540000000000006 110.858 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.23 -41.59 81.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.918 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.463 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.8 OUTLIER -55.93 -48.56 75.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 71.439999999999998 110.905 -179.949 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.511 HG21 ' CH2' ' A' ' 82' ' ' TRP . 87.9 t -61.81 -40.23 86.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 74.209999999999994 111.165 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -56.67 -38.44 72.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.493 . . . . 74.519999999999996 110.864 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -51.13 25.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 65.349999999999994 110.821 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.464 ' CD1' HD13 ' A' ' 163' ' ' LEU . 36.2 m-85 -64.28 -20.94 66.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 72.430000000000007 110.925 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.511 ' OG1' HD12 ' A' ' 167' ' ' LEU . 85.1 m -84.44 -29.48 26.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.118 -0.492 . . . . 71.019999999999996 111.122 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 89.0 m -79.44 -24.24 42.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.429 . . . . 64.430000000000007 111.167 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -162.54 166.15 25.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 70.409999999999997 110.907 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.89 -55.62 16.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 74.530000000000001 111.121 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 59.03 21.62 9.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.282 -0.417 . . . . 65.299999999999997 110.837 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 107.62 13.66 19.88 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.76 -0.733 . . . . 62.219999999999999 112.544 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.464 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.9 mp -108.15 136.25 48.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.882 0.372 . . . . 71.099999999999994 110.891 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 26.3 t -51.48 -30.25 19.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 70.049999999999997 110.942 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.46 ' HB ' HG22 ' A' ' 101' ' ' THR . 2.9 t -151.65 119.39 6.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 64.019999999999996 111.195 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.76 153.24 2.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.256 -0.429 . . . . 75.430000000000007 110.953 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.511 HD12 ' OG1' ' A' ' 157' ' ' THR . 6.3 mt -69.44 133.44 47.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.431 . . . . 70.129999999999995 110.996 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.688 HD12 ' O ' ' A' ' 101' ' ' THR . 22.4 mt -127.2 -51.23 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 65.310000000000002 111.158 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt -126.2 118.92 23.51 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.579 0.704 . . . . 72.430000000000007 110.892 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 131.91 22.31 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.712 2.275 . . . . 73.219999999999999 112.375 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 83.67 0.53 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 73.299999999999997 110.872 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 31.6 m -64.71 144.92 14.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.44 . . . . 75.230000000000004 111.162 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 52.409999999999997 110.872 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.666 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.729 0.3 . . . . 72.450000000000003 110.994 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 11.1 p -105.35 88.61 2.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 75.340000000000003 110.809 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -81.63 151.13 27.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.141 -0.481 . . . . 75.019999999999996 110.973 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 297' ' ' LYS . . . . . 0.426 ' O ' ' HE1' ' B' ' 313' ' ' MET . 0.0 OUTLIER -148.2 129.22 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 71.310000000000002 110.855 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.08 159.28 15.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 70.519999999999996 110.831 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 45.4 mtt180 -60.15 -18.48 47.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.094 -0.503 . . . . 71.5 110.873 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.05 -43.41 87.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 74.040000000000006 110.863 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.37 -23.18 17.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 70.120000000000005 110.918 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.408 ' HB2' HD11 ' B' ' 305' ' ' LEU . 53.6 m-20 -144.52 77.45 13.82 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.624 0.726 . . . . 73.030000000000001 110.819 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.84 -5.8 17.12 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.703 2.268 . . . . 44.439999999999998 112.3 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.3 t -92.63 27.52 2.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.232 -0.44 . . . . 72.0 111.207 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.408 HD11 ' HB2' ' B' ' 302' ' ' ASP . 24.4 mt -103.92 136.71 43.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 73.25 110.88 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.638 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.1 t -104.5 171.99 7.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 73.019999999999996 111.149 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -49.35 -36.82 22.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.272 -0.422 . . . . 74.430000000000007 110.885 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.86 -52.08 66.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.197 -0.456 . . . . 73.230000000000004 110.932 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.638 ' HG2' HG22 ' B' ' 306' ' ' THR . 18.8 mm-40 -64.15 -52.56 58.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.474 . . . . 71.340000000000003 110.932 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.473 HD13 ' HE2' ' B' ' 313' ' ' MET . 48.0 mm -55.85 -54.52 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 74.510000000000005 111.208 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 33.3 t -59.43 -21.38 59.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 73.430000000000007 110.872 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.14 3.9 25.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 72.25 111.143 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 313' ' ' MET . . . . . 0.473 ' HE2' HD13 ' B' ' 310' ' ' ILE . 1.2 mtm . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 63.520000000000003 110.87 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.457 -0.094 0 CA-C-O 120.935 0.397 . . . . 53.240000000000002 110.868 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.4 m 66.49 136.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 75.310000000000002 110.922 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.482 HG21 ' CB ' ' A' ' 141' ' ' ASP . 5.8 m -51.25 121.97 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 72.450000000000003 111.142 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -128.4 78.41 1.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 64.530000000000001 110.86 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 23.7 mtmt . . . . . 0 C--N 1.329 -0.318 0 CA-C-O 121.655 0.74 . . . . 63.409999999999997 110.844 179.936 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.174 0 CA-C-O 120.711 0.213 . . . . 72.209999999999994 112.272 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.456 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 38.9 p-90 -101.57 -30.51 11.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 74.239999999999995 110.909 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -86.41 99.09 11.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.41 . . . . 74.129999999999995 110.886 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.4 m80 -76.56 -40.39 49.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 71.109999999999999 110.903 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.83 24.86 54.98 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 75.230000000000004 112.506 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.96 66.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.743 0.306 . . . . 74.329999999999998 110.899 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 14.2 mm -129.74 144.32 38.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 55.210000000000001 111.131 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.465 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -95.49 170.49 9.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 45.409999999999997 111.105 179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.465 ' H ' HG22 ' A' ' 88' ' ' THR . 1.9 ppt_? -60.9 -39.45 89.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 73.450000000000003 110.82 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -74.05 -33.78 63.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 73.329999999999998 110.9 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -70.82 -40.83 72.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 74.140000000000001 110.926 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.468 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -75.18 -34.13 61.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 45.039999999999999 111.135 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -60.07 -52.98 63.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 62.340000000000003 110.861 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.75 -36.35 82.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 75.430000000000007 110.929 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 92' ' ' ALA . 11.1 mt -55.01 -38.26 67.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.131 -0.486 . . . . 72.430000000000007 110.92 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.69 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.6 mm? -102.03 43.76 1.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 71.340000000000003 110.929 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.502 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.54 -59.68 6.67 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.631 0.729 . . . . 71.430000000000007 110.897 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.81 123.61 10.25 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.64 2.227 . . . . 75.230000000000004 112.373 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 116.82 4.74 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.674 2.249 . . . . 51.439999999999998 112.351 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -154.87 115.16 3.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 72.349999999999994 110.939 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.685 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.4 OUTLIER -66.6 111.69 3.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.166 -0.47 . . . . 73.519999999999996 111.165 -179.888 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.19 -5.07 6.37 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.705 -0.759 . . . . 74.049999999999997 112.44 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.428 HD12 ' O ' ' A' ' 169' ' ' LYS . 2.9 tp -90.6 113.15 25.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.838 0.352 . . . . 72.209999999999994 110.894 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.653 ' HB2' HD11 ' A' ' 118' ' ' LEU . 16.6 p90 -124.38 168.42 13.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 73.400000000000006 110.875 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.599 HD23 HD21 ' A' ' 96' ' ' LEU . 0.7 OUTLIER -164.03 137.14 5.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 64.319999999999993 110.934 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.485 HG11 HD22 ' A' ' 149' ' ' LEU . 89.5 t -110.65 135.73 48.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 72.439999999999998 111.164 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -149.3 143.01 25.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 70.310000000000002 110.866 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -54.88 124.08 15.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.181 -0.463 . . . . 62.520000000000003 110.885 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.2 m -56.37 115.91 2.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.078 -0.51 . . . . 74.019999999999996 110.855 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.4 m -68.61 -56.28 8.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 62.109999999999999 111.13 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.409 ' ND2' HG23 ' B' ' 310' ' ' ILE . 26.0 p30 -68.19 -19.55 64.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 71.420000000000002 110.963 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.429 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 1.3 m-85 -124.75 93.15 46.61 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.673 0.749 . . . . 74.150000000000006 110.934 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 54.0 Cg_endo -69.71 119.84 6.72 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.668 2.245 . . . . 72.340000000000003 112.409 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.73 -10.45 23.42 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.792 -0.718 . . . . 62.43 112.473 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -119.46 -178.61 3.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.802 0.334 . . . . 71.109999999999999 110.838 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -130.59 162.15 29.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 70.430000000000007 110.885 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 96.4 m -130.32 125.33 34.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.111 -0.495 . . . . 63.119999999999997 111.195 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.653 HD11 ' HB2' ' A' ' 104' ' ' PHE . 30.2 tp -98.57 112.6 24.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.277 -0.419 . . . . 74.349999999999994 110.881 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.1 m -101.04 126.35 47.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 72.0 110.877 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.524 HG21 ' CD1' ' A' ' 163' ' ' LEU . 11.7 t -127.55 151.21 34.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 53.539999999999999 111.116 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.69 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -100.27 112.62 24.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 70.549999999999997 110.845 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.96 94.27 4.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 72.0 110.909 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 65.58 25.52 11.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.030000000000001 110.897 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.9 8.85 55.19 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 51.030000000000001 112.535 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -110.55 139.09 46.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.768 0.318 . . . . 64.319999999999993 110.874 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.607 ' O ' HD13 ' B' ' 294' ' ' LEU . 69.3 t -95.17 101.21 12.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 73.030000000000001 111.162 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -90.24 110.23 21.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 73.549999999999997 110.88 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -89.03 124.52 34.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 60.200000000000003 110.84 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.53 ' HB3' HD13 ' A' ' 140' ' ' ILE . 66.3 m-85 -113.93 104.49 12.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 62.210000000000001 110.908 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -53.76 133.66 42.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.08 -0.509 . . . . 70.439999999999998 110.845 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 65.2 mt -113.13 106.95 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.456 . . . . 63.210000000000001 111.153 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.1 ttm -76.69 129.31 36.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 63.219999999999999 110.942 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -114.88 115.97 27.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 74.030000000000001 110.972 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -149.58 137.03 20.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 64.109999999999999 110.869 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.46 36.11 24.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 62.520000000000003 111.101 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.57 25.41 14.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 73.010000000000005 110.813 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -126.24 144.02 50.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 71.310000000000002 110.892 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.9 mp -106.5 150.7 25.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.258 -0.428 . . . . 73.420000000000002 110.913 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -168.26 134.84 2.0 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.184 -0.462 . . . . 72.510000000000005 110.855 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.597 ' CG2' HG13 ' B' ' 317' ' ' VAL . 50.0 mt -110.77 -33.48 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 74.340000000000003 111.138 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.789 ' HB3' HG21 ' B' ' 317' ' ' VAL . 3.4 p30 -95.48 9.8 38.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.114 -0.494 . . . . 74.129999999999995 110.864 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 6.7 pt-20 45.48 31.29 0.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.540000000000006 110.973 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -131.86 -39.47 1.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.079 -0.51 . . . . 70.430000000000007 110.86 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.527 HG12 ' OD1' ' A' ' 141' ' ' ASP . 2.7 p -118.52 104.55 16.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 64.430000000000007 111.136 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -91.91 149.83 21.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 74.219999999999999 110.891 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -120.09 173.76 6.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 64.049999999999997 110.887 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -93.84 -18.19 22.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 52.25 110.886 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -172.05 158.7 4.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 64.109999999999999 110.888 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.485 HD22 HG11 ' A' ' 106' ' ' VAL . 0.6 OUTLIER -51.19 -36.02 39.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 74.439999999999998 110.881 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.5 ttt -52.47 -51.14 60.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 63.439999999999998 110.928 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.99 -40.05 90.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 72.150000000000006 110.951 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.71 -49.71 72.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.212 -0.449 . . . . 73.209999999999994 110.927 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.64 HG13 HD12 ' A' ' 167' ' ' LEU . 96.5 t -59.04 -44.62 91.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 72.140000000000001 111.18 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -52.97 -38.99 62.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.102 -0.499 . . . . 70.549999999999997 110.837 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -53.43 16.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 62.240000000000002 110.882 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.73 ' CE1' HD23 ' A' ' 163' ' ' LEU . 51.4 m-85 -62.65 -17.27 60.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 55.539999999999999 110.896 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 99.6 m -85.83 -32.46 21.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 70.120000000000005 111.15 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 16.2 m -79.68 -22.49 43.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 74.239999999999995 111.17 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -165.88 161.68 17.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 75.400000000000006 110.893 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.31 -58.35 6.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 72.519999999999996 111.108 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.01 16.6 9.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.256 -0.429 . . . . 52.509999999999998 110.873 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 115.3 1.45 21.95 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.695 -0.764 . . . . 62.509999999999998 112.467 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.73 HD23 ' CE1' ' A' ' 156' ' ' TYR . 0.9 OUTLIER -93.41 140.39 29.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.801 0.334 . . . . 72.010000000000005 110.889 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 34.6 t -51.06 -30.56 16.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.201 -0.454 . . . . 73.120000000000005 110.848 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.6 t -158.66 125.11 4.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.246 -0.434 . . . . 55.140000000000001 111.183 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -50.77 146.22 6.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 74.439999999999998 110.857 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.64 HD12 HG13 ' A' ' 153' ' ' VAL . 7.3 mt -65.04 134.78 54.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 74.310000000000002 110.899 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.685 HD12 ' O ' ' A' ' 101' ' ' THR . 25.1 mt -127.13 -51.17 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 52.329999999999998 111.11 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 169' ' ' LYS . . . . . 0.428 ' O ' HD12 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -127.77 118.82 21.19 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.556 0.693 . . . . 63.299999999999997 110.904 179.838 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 141.96 46.81 Favored 'Trans proline' 0 C--O 1.232 0.215 0 C-N-CA 122.724 2.283 . . . . 64.010000000000005 112.375 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 171' ' ' LYS . . . . . 0.416 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -70.63 82.51 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.237 -0.438 . . . . 50.520000000000003 110.923 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 13.5 m -65.0 124.76 20.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 75.099999999999994 111.124 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.2 ptm . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 74.219999999999999 110.887 179.911 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.607 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.731 0.3 . . . . 72.420000000000002 110.94 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.2 t -96.65 88.64 4.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.161 -0.472 . . . . 63.350000000000001 110.885 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -77.66 147.87 35.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.495 . . . . 73.209999999999994 110.904 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -151.39 129.54 11.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 72.239999999999995 110.929 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.84 175.0 5.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 62.409999999999997 110.843 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 36.4 mtt180 -64.24 -15.5 60.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.094 -0.503 . . . . 70.439999999999998 110.842 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.16 -42.75 99.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 75.030000000000001 110.836 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -102.43 -10.75 19.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.165 -0.47 . . . . 74.319999999999993 110.931 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.525 ' HB2' HD11 ' B' ' 305' ' ' LEU . 10.4 m-20 -156.83 77.62 4.06 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.592 0.71 . . . . 72.420000000000002 110.862 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -6.26 18.18 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.712 2.275 . . . . 63.049999999999997 112.337 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.8 t -93.31 27.15 2.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 75.340000000000003 111.135 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.525 HD11 ' HB2' ' B' ' 302' ' ' ASP . 34.8 mt -103.98 136.84 42.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 74.109999999999999 110.947 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.615 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.7 t -103.4 174.24 5.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 42.039999999999999 111.13 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -49.87 -34.37 19.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 73.040000000000006 110.895 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 308' ' ' GLU . . . . . 0.443 ' H ' HG23 ' B' ' 306' ' ' THR . 4.0 tp10 -64.95 -48.95 72.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.482 . . . . 71.540000000000006 110.921 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.615 ' HG2' HG22 ' B' ' 306' ' ' THR . 21.3 mm-40 -64.89 -52.22 57.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.074 -0.512 . . . . 75.430000000000007 110.872 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.409 HG23 ' ND2' ' A' ' 111' ' ' ASN . 43.9 mm -57.17 -53.28 45.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 72.219999999999999 111.145 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 46.8 m -63.67 -18.44 63.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 64.519999999999996 110.792 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.38 2.99 29.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 62.240000000000002 111.168 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.7 mtt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 62.420000000000002 110.925 179.952 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 13.2 p . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.914 0.388 . . . . 73.120000000000005 110.903 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 62.86 161.56 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.098 -0.501 . . . . 53.420000000000002 110.814 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.789 HG21 ' HB3' ' A' ' 141' ' ' ASP . 15.3 m -68.6 134.47 30.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.108 -0.497 . . . . 62.200000000000003 111.15 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -132.14 74.38 1.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 73.019999999999996 110.91 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 34.1 mttt . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.595 0.712 . . . . 72.049999999999997 110.876 179.878 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.783 0.243 . . . . 74.040000000000006 112.325 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.437 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 39.0 p-90 -102.86 -31.01 10.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.271 -0.422 . . . . 75.340000000000003 110.892 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -86.44 102.06 13.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.239999999999995 110.893 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.0 m80 -76.25 -36.63 58.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 61.310000000000002 110.891 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.39 18.75 37.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.736 -0.745 . . . . 40.25 112.554 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.51 78.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 64.530000000000001 110.872 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.498 HG21 ' HB2' ' A' ' 92' ' ' ALA . 13.4 mm -139.21 144.28 29.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 75.200000000000003 111.103 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.449 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -96.11 176.01 6.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.103 -0.499 . . . . 75.519999999999996 111.195 179.933 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.449 ' H ' HG22 ' A' ' 88' ' ' THR . 5.5 ppt_? -65.44 -39.12 91.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.224 -0.444 . . . . 74.430000000000007 110.908 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -74.61 -33.07 62.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.165 -0.47 . . . . 62.399999999999999 110.883 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -71.77 -43.06 66.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 75.010000000000005 110.878 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.498 ' HB2' HG21 ' A' ' 87' ' ' ILE . . . -75.04 -33.82 61.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 65.540000000000006 111.126 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -60.25 -53.28 59.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 63.329999999999998 110.892 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -36.58 83.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.489 . . . . 72.25 110.892 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' A' ' 92' ' ' ALA . 12.0 mt -55.01 -38.18 67.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.188 -0.46 . . . . 45.229999999999997 110.88 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.676 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.2 mm? -102.03 43.75 1.05 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.228 -0.442 . . . . 71.010000000000005 110.917 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.62 -59.91 6.27 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.679 0.752 . . . . 74.439999999999998 110.975 179.933 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.7 Cg_endo -69.83 123.25 9.89 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.631 2.22 . . . . 73.329999999999998 112.326 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 117.58 5.17 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.677 2.251 . . . . 71.450000000000003 112.331 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -154.81 108.17 2.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.176 -0.465 . . . . 61.109999999999999 110.905 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.659 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -60.79 112.79 2.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 74.219999999999999 111.19 -179.923 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.09 -6.9 6.39 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.745 -0.741 . . . . 63.439999999999998 112.495 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.13 115.44 27.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.855 0.36 . . . . 72.140000000000001 110.924 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -126.77 164.36 21.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 74.010000000000005 110.882 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.587 HD23 HD21 ' A' ' 96' ' ' LEU . 0.7 OUTLIER -161.13 137.93 8.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 72.299999999999997 110.879 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.437 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 92.3 t -110.3 140.27 30.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 65.040000000000006 111.08 179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -153.15 145.58 24.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 73.109999999999999 110.866 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.53 125.02 13.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 72.140000000000001 110.895 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.5 m -58.38 113.19 1.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 72.340000000000003 110.774 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.58 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.9 m -68.92 -56.27 8.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 63.240000000000002 111.097 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.637 ' CG ' HD12 ' B' ' 310' ' ' ILE . 34.2 m-80 -65.02 -27.88 69.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 63.229999999999997 110.917 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -117.64 94.62 46.2 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.675 0.75 . . . . 72.25 110.927 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 118.09 5.48 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.656 2.237 . . . . 64.209999999999994 112.338 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.57 -1.32 24.85 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.757 -0.735 . . . . 54.100000000000001 112.485 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -129.06 -173.41 2.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.799 0.333 . . . . 70.109999999999999 110.872 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -134.52 166.61 22.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 74.120000000000005 110.88 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 57.6 m -138.38 141.6 39.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.098 -0.501 . . . . 64.040000000000006 111.14 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.591 ' CD2' HD11 ' A' ' 163' ' ' LEU . 0.4 OUTLIER -110.96 118.23 35.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 75.319999999999993 110.949 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.5 m -101.59 125.92 48.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.44 . . . . 72.530000000000001 110.892 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.412 HG21 HD12 ' A' ' 163' ' ' LEU . 15.4 t -126.1 150.91 31.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 63.439999999999998 111.12 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.676 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.99 111.64 24.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.420000000000002 110.878 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.73 93.11 3.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.475 . . . . 75.239999999999995 110.931 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 66.81 29.8 8.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 74.340000000000003 110.936 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.9 -14.0 63.17 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.763 -0.732 . . . . 74.430000000000007 112.508 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -88.14 139.29 30.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 71.230000000000004 110.919 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.647 ' O ' HD13 ' B' ' 294' ' ' LEU . 95.6 t -100.09 111.27 29.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 74.420000000000002 111.138 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.541 ' OE2' HD11 ' B' ' 294' ' ' LEU . 5.0 mm-40 -100.96 124.18 46.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 61.140000000000001 110.928 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -101.6 124.76 47.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 74.409999999999997 110.825 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.61 ' CE1' HD13 ' A' ' 163' ' ' LEU . 72.9 m-85 -112.3 112.73 24.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.467 . . . . 71.329999999999998 110.968 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -62.2 139.27 58.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 63.509999999999998 110.883 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.456 ' CG2' HD23 ' A' ' 138' ' ' LEU . 60.2 mt -119.69 109.61 26.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 72.140000000000001 111.104 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.38 123.29 30.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 64.319999999999993 110.89 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.481 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -112.4 98.23 7.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 72.439999999999998 110.951 -179.901 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -131.47 142.61 50.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 74.5 110.865 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.65 36.1 26.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 64.310000000000002 111.113 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.51 26.44 16.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 60.420000000000002 110.872 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -131.34 139.33 49.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 71.299999999999997 110.907 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.481 HD21 ' CE2' ' A' ' 133' ' ' TYR . 4.0 mp -102.08 150.46 23.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.465 . . . . 74.310000000000002 110.93 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -167.79 138.37 2.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.209999999999994 110.875 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.561 HG22 HG13 ' B' ' 317' ' ' VAL . 50.3 mt -112.93 -34.87 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 73.129999999999995 111.071 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.616 ' HB3' HG21 ' B' ' 317' ' ' VAL . 7.6 p30 -89.14 -1.67 58.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.254 -0.43 . . . . 65.129999999999995 110.853 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 61.12 17.49 8.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 73.209999999999994 110.805 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -127.21 -33.36 2.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.219999999999999 110.915 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -113.36 104.86 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 71.430000000000007 111.103 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -97.19 145.65 25.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 73.510000000000005 111.009 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' PHE . . . . . 0.448 ' CD1' HD12 ' A' ' 152' ' ' LEU . 53.8 m-85 -118.52 178.1 4.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 74.409999999999997 110.806 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.68 -15.63 17.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.112 -0.495 . . . . 74.340000000000003 110.912 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -165.48 172.2 12.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 74.239999999999995 110.871 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.405 ' H ' HD12 ' A' ' 149' ' ' LEU . 0.6 OUTLIER -74.71 -23.88 58.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 75.109999999999999 110.901 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -57.19 11.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 65.030000000000001 110.866 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -65.08 -35.33 80.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 73.310000000000002 110.908 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.448 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.57 -47.57 76.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.430000000000007 110.929 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.472 HG13 HD12 ' A' ' 167' ' ' LEU . 75.2 t -64.99 -39.48 85.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 54.229999999999997 111.142 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -54.43 -37.83 65.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.109 -0.496 . . . . 74.239999999999995 110.958 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.03 -44.84 62.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.107 -0.497 . . . . 72.400000000000006 110.88 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.474 ' CE1' HD23 ' A' ' 163' ' ' LEU . 38.3 m-85 -67.96 -22.09 65.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.451 . . . . 75.200000000000003 110.898 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.496 HG23 ' O ' ' A' ' 167' ' ' LEU . 55.5 m -84.24 -30.04 26.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 61.530000000000001 111.164 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 19.2 m -78.96 -25.83 43.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.213 -0.449 . . . . 62.399999999999999 111.118 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.66 161.68 29.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.194 -0.457 . . . . 41.210000000000001 110.868 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.1 -58.32 6.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.419 . . . . 43.5 111.103 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 60.2 19.51 8.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.459 . . . . 72.409999999999997 110.907 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 114.43 0.76 23.44 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.696 -0.764 . . . . 73.540000000000006 112.449 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.61 HD13 ' CE1' ' A' ' 129' ' ' TYR . 3.0 mm? -93.83 139.2 31.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.888 0.375 . . . . 75.409999999999997 110.918 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 36.0 t -51.27 -30.29 17.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 74.120000000000005 110.822 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.1 t -156.42 125.7 6.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 42.020000000000003 111.137 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -50.73 142.22 11.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.227 -0.442 . . . . 74.340000000000003 110.819 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.496 ' O ' HG23 ' A' ' 157' ' ' THR . 8.6 mt -64.31 134.62 55.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.14 -0.482 . . . . 64.219999999999999 110.847 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.659 HD12 ' O ' ' A' ' 101' ' ' THR . 28.8 mt -121.77 -51.25 3.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 71.420000000000002 111.112 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -132.42 126.36 20.19 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.595 0.712 . . . . 74.120000000000005 110.887 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.85 140.58 42.69 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.662 2.241 . . . . 64.439999999999998 112.343 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.09 83.48 0.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.274 -0.421 . . . . 75.349999999999994 110.931 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 29.1 m -64.46 129.91 28.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 71.439999999999998 111.173 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.4 ptt? . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 52.229999999999997 110.899 179.949 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.647 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.793 0.33 . . . . 74.219999999999999 110.926 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.91 88.5 2.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 70.530000000000001 110.801 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -74.63 149.23 40.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.153 -0.476 . . . . 75.230000000000004 110.92 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 297' ' ' LYS . . . . . 0.407 ' O ' ' HE1' ' B' ' 313' ' ' MET . 0.4 OUTLIER -144.55 129.09 18.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.106 -0.497 . . . . 75.129999999999995 110.904 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 298' ' ' SER . . . . . 0.58 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -91.79 157.02 17.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 73.409999999999997 110.852 -179.919 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -59.31 -18.94 42.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.093 -0.503 . . . . 74.129999999999995 110.869 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -36.65 84.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 72.400000000000006 110.85 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -97.7 -24.55 15.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 72.120000000000005 110.893 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.428 ' HB2' HD11 ' B' ' 305' ' ' LEU . 9.2 m-20 -144.59 79.21 12.59 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.677 0.751 . . . . 54.200000000000003 110.915 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 -5.83 17.19 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.617 2.211 . . . . 61.25 112.326 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.0 t -93.24 27.43 2.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 74.239999999999995 111.145 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.428 HD11 ' HB2' ' B' ' 302' ' ' ASP . 29.2 mt -101.31 136.83 40.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.235 -0.439 . . . . 75.150000000000006 110.981 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.638 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.2 t -105.95 172.81 6.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 75.140000000000001 111.118 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -49.43 -37.34 25.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 63.310000000000002 110.924 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -60.75 -52.43 65.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 74.140000000000001 110.85 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.638 ' HG2' HG22 ' B' ' 306' ' ' THR . 10.0 mm-40 -63.64 -52.39 60.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.475 . . . . 70.120000000000005 110.915 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.637 HD12 ' CG ' ' A' ' 111' ' ' ASN . 43.3 mm -55.83 -53.77 34.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 73.299999999999997 111.171 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 7.8 t -58.67 -22.84 58.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 72.109999999999999 110.855 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.54 4.28 25.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 64.420000000000002 111.054 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 313' ' ' MET . . . . . 0.626 ' HE2' HD13 ' B' ' 310' ' ' ILE . 1.4 mtm . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 70.409999999999997 110.894 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 21.2 p . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.897 0.38 . . . . 70.049999999999997 110.829 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 66.65 130.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 73.439999999999998 110.853 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.616 HG21 ' HB3' ' A' ' 141' ' ' ASP . 6.0 m -50.22 133.51 10.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 65.129999999999995 111.112 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.49 74.48 1.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 71.140000000000001 110.892 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.8 mttp . . . . . 0 C--N 1.329 -0.316 0 CA-C-O 121.627 0.727 . . . . 74.540000000000006 110.911 179.872 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.23 0.119 0 CA-C-O 120.735 0.223 . . . . 65.109999999999999 112.283 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.448 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 32.4 p-90 -101.51 -30.73 11.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.439 . . . . 74.439999999999998 110.888 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -89.91 108.1 19.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.419 . . . . 71.430000000000007 110.936 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -83.44 -46.97 11.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 50.119999999999997 110.891 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.89 33.0 71.57 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.707 -0.759 . . . . 54.299999999999997 112.538 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.61 33.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.712 0.292 . . . . 65.200000000000003 110.922 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.4 HG21 ' HB2' ' A' ' 92' ' ' ALA . 7.4 mm -103.3 144.07 14.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.420000000000002 111.072 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.19 159.35 16.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.125 -0.488 . . . . 73.120000000000005 111.213 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -54.14 -37.94 64.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 74.329999999999998 110.904 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -77.15 -32.05 56.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.232 -0.44 . . . . 73.030000000000001 110.829 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -70.09 -39.49 75.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 72.030000000000001 110.915 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.472 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -74.99 -35.99 62.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 70.5 111.151 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -58.87 -52.85 63.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 34.210000000000001 110.927 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.75 -35.63 80.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.495 . . . . 72.200000000000003 110.862 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 92' ' ' ALA . 11.5 mt -54.9 -38.49 67.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 74.540000000000006 110.926 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.701 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -98.46 43.67 1.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 64.019999999999996 110.949 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.503 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.72 -59.92 6.15 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.622 0.725 . . . . 75.340000000000003 110.912 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.9 Cg_endo -69.68 123.35 10.04 Favored 'Trans proline' 0 N--CA 1.465 -0.195 0 C-N-CA 122.73 2.287 . . . . 73.040000000000006 112.347 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 117.67 5.22 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.68 2.254 . . . . 75.310000000000002 112.333 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.9 105.29 2.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.217 -0.447 . . . . 73.400000000000006 110.862 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.691 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.0 OUTLIER -58.64 111.9 1.42 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.127 -0.488 . . . . 63.140000000000001 111.11 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.32 -5.09 6.32 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.718 -0.753 . . . . 64.109999999999999 112.511 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.31 117.49 29.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.876 0.37 . . . . 74.230000000000004 110.924 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.503 ' HB3' HD22 ' A' ' 167' ' ' LEU . 23.9 p90 -128.5 166.79 18.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.164 -0.471 . . . . 72.310000000000002 110.885 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.651 HD23 HD21 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -164.23 138.72 5.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 74.409999999999997 110.874 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.448 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 92.9 t -109.92 131.19 61.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 71.120000000000005 111.211 179.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.26 145.71 41.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 71.200000000000003 110.879 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.76 123.92 8.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 74.140000000000001 110.893 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.5 m -62.16 109.3 1.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 51.420000000000002 110.856 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.584 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.5 m -68.69 -56.31 8.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 73.329999999999998 111.167 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.54 ' CG ' HD12 ' B' ' 310' ' ' ILE . 67.2 m-80 -64.38 -27.04 68.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.196 -0.457 . . . . 65.120000000000005 110.823 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.413 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 2.4 m-85 -118.43 95.73 49.03 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.677 0.751 . . . . 65.200000000000003 110.869 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.6 Cg_endo -69.77 114.34 3.67 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.638 2.225 . . . . 61.240000000000002 112.368 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.41 -1.18 25.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.729 -0.748 . . . . 72.0 112.532 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -123.47 -172.97 2.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.789 0.328 . . . . 72.510000000000005 110.832 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -139.98 145.12 37.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 73.120000000000005 110.904 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.4 m -113.6 141.63 46.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 63.399999999999999 111.136 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.529 ' CD2' HD11 ' A' ' 163' ' ' LEU . 0.4 OUTLIER -113.14 118.97 36.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.244 -0.434 . . . . 44.399999999999999 110.913 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 14.7 t -102.66 129.94 49.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.445 . . . . 73.239999999999995 110.85 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.419 HG21 HD12 ' A' ' 163' ' ' LEU . 11.7 t -128.53 150.01 33.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.030000000000001 111.092 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.701 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.12 112.45 25.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 74.409999999999997 110.895 -179.828 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.13 91.46 3.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.116 -0.493 . . . . 62.140000000000001 110.862 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 66.35 32.21 7.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 73.0 110.896 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.34 -13.76 64.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.712 -0.756 . . . . 54.140000000000001 112.476 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.03 145.69 25.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.833 0.349 . . . . 70.319999999999993 110.909 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.485 ' O ' HD13 ' B' ' 294' ' ' LEU . 6.8 m -106.08 116.38 49.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 63.420000000000002 111.166 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -107.28 122.8 47.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 74.530000000000001 110.822 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -99.78 124.16 44.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 62.32 110.804 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.635 ' CE1' HD13 ' A' ' 163' ' ' LEU . 56.4 m-85 -110.8 116.99 32.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 54.140000000000001 110.881 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 129.73 40.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 75.549999999999997 110.78 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.497 HG12 HD11 ' A' ' 140' ' ' ILE . 33.3 mt -113.66 109.41 28.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 45.329999999999998 111.153 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -81.41 125.22 30.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 31.23 110.913 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.46 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.97 101.06 8.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.261 -0.427 . . . . 73.530000000000001 110.907 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -137.36 142.55 41.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 74.109999999999999 110.894 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.66 35.87 24.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 73.540000000000006 111.158 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 2.7 t 60.26 31.87 20.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 62.439999999999998 110.795 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mtmm -137.92 142.56 40.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.174 -0.466 . . . . 74.319999999999993 110.884 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.46 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 4.4 mp -105.64 152.2 23.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 70.409999999999997 110.929 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -169.59 139.94 2.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.449 . . . . 73.450000000000003 110.816 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.524 ' CG2' HG13 ' B' ' 317' ' ' VAL . 58.4 mt -115.65 -37.14 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 74.329999999999998 111.145 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.65 ' HB3' HG21 ' B' ' 317' ' ' VAL . 23.6 p30 -89.19 -5.26 57.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 75.129999999999995 110.915 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 61.98 15.87 7.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 62.140000000000001 110.901 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -123.79 -9.19 7.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.074 -0.512 . . . . 74.239999999999995 110.896 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.5 t -143.48 104.53 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.101 -0.5 . . . . 62.520000000000003 111.073 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -94.99 145.47 24.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 53.119999999999997 110.89 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' PHE . . . . . 0.432 ' CD1' HD12 ' A' ' 152' ' ' LEU . 49.3 m-85 -117.09 178.05 4.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 73.319999999999993 110.869 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.68 -15.69 17.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 64.540000000000006 110.92 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.429 ' C ' HD13 ' A' ' 138' ' ' LEU . 1.5 t30 -165.76 172.07 12.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 71.329999999999998 110.849 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.5 -23.26 58.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 62.219999999999999 110.894 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.5 ttp -62.55 -57.19 12.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 63.420000000000002 110.864 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -65.73 -35.66 81.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.456 . . . . 71.109999999999999 110.97 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.432 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.54 -48.46 74.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.466 . . . . 64.310000000000002 110.958 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.77 HG13 HD12 ' A' ' 167' ' ' LEU . 71.0 t -64.79 -38.01 81.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.489 . . . . 75.120000000000005 111.124 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -55.4 -38.32 68.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 73.420000000000002 110.904 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -72.22 -45.2 61.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.430000000000007 110.826 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.526 ' CD1' HD23 ' A' ' 163' ' ' LEU . 32.5 m-85 -69.92 -15.82 63.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 75.099999999999994 110.968 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.421 HG23 ' O ' ' A' ' 167' ' ' LEU . 96.8 m -86.96 -34.16 19.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.079 -0.509 . . . . 74.319999999999993 111.128 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.5 t -80.09 -23.45 41.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 60.039999999999999 111.164 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.25 153.65 24.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 64.120000000000005 110.855 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.51 -58.16 7.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 41.530000000000001 111.116 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 56.21 25.19 8.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 55.200000000000003 110.928 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 119.28 -11.3 11.5 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.742 -0.742 . . . . 71.420000000000002 112.483 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.635 HD13 ' CE1' ' A' ' 129' ' ' TYR . 3.8 mm? -86.93 138.38 31.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.896 0.379 . . . . 70.319999999999993 110.894 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 19.5 t -51.23 -29.51 14.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.141 -0.481 . . . . 72.019999999999996 110.856 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.467 HG21 HG22 ' A' ' 101' ' ' THR . 4.5 t -158.99 128.13 5.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 72.400000000000006 111.095 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -51.62 139.53 20.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 73.209999999999994 110.928 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.77 HD12 HG13 ' A' ' 153' ' ' VAL . 8.5 mt -60.95 139.54 58.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.258 -0.428 . . . . 65.239999999999995 110.874 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.691 HD12 ' O ' ' A' ' 101' ' ' THR . 26.4 mt -127.13 -51.5 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 53.509999999999998 111.148 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -128.15 122.04 21.94 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.578 0.704 . . . . 72.219999999999999 110.932 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 138.45 37.99 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.753 2.302 . . . . 72.519999999999996 112.329 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.42 84.03 0.4 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 61.420000000000002 110.899 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 28.7 m -64.38 138.52 22.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.438 . . . . 71.519999999999996 111.174 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.1 ptm . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 75.450000000000003 110.844 179.992 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.485 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.774 0.321 . . . . 65.519999999999996 110.899 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 4.4 p -96.72 88.88 4.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 61.240000000000002 110.859 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -77.0 145.64 37.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.11 -0.495 . . . . 73.549999999999997 110.962 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -136.7 129.58 30.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 63.340000000000003 110.888 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 298' ' ' SER . . . . . 0.584 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -91.82 164.31 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.276 -0.42 . . . . 62.5 110.853 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 28.6 mtt180 -67.78 -12.47 60.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 61.420000000000002 110.889 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.23 -37.84 66.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 71.540000000000006 110.889 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -95.93 -16.84 21.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.139 -0.482 . . . . 73.230000000000004 110.904 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.531 ' HB2' HD11 ' B' ' 305' ' ' LEU . 31.5 m-20 -153.73 79.08 5.39 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.646 0.736 . . . . 70.200000000000003 110.912 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 -6.57 18.88 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.709 2.272 . . . . 60.039999999999999 112.33 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 15.3 t -93.78 27.24 2.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 43.439999999999998 111.113 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' B' ' 302' ' ' ASP . 44.5 mt -101.31 136.79 40.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.202 -0.454 . . . . 62.32 110.985 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.59 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.0 t -103.17 169.99 8.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 52.530000000000001 111.103 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -49.66 -32.5 13.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.209999999999994 110.856 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -63.98 -47.64 79.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 60.229999999999997 110.875 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.59 ' HG2' HG22 ' B' ' 306' ' ' THR . 3.4 mm-40 -65.34 -49.27 70.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 54.140000000000001 110.879 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.54 HD12 ' CG ' ' A' ' 111' ' ' ASN . 24.3 mm -61.54 -53.24 51.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 65.109999999999999 111.202 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 79.3 p -58.57 -23.39 58.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 73.040000000000006 110.855 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -78.79 -1.63 35.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.479 . . . . 60.020000000000003 111.062 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 74.430000000000007 110.931 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.816 0.341 . . . . 63.119999999999997 110.808 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 5.8 t 65.12 151.69 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 73.049999999999997 110.838 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.65 HG21 ' HB3' ' A' ' 141' ' ' ASP . 6.8 m -59.02 120.32 4.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.093 -0.503 . . . . 71.040000000000006 111.14 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -127.34 74.85 1.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 71.030000000000001 110.918 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 121.654 0.74 . . . . 74.230000000000004 110.881 179.925 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo . . . . . 0 N--CA 1.465 -0.163 0 CA-C-O 120.872 0.28 . . . . 71.109999999999999 112.379 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.469 ' CH2' HG21 ' A' ' 153' ' ' VAL . 37.0 p-90 -100.2 -25.99 14.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.465 . . . . 65.049999999999997 110.918 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -98.73 103.14 15.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.249 -0.432 . . . . 75.239999999999995 110.913 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -79.58 -45.43 19.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 65.109999999999999 110.938 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 60.82 35.31 89.88 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.699 -0.762 . . . . 60.020000000000003 112.497 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.3 34.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.743 0.306 . . . . 73.510000000000005 110.885 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.605 HG23 ' HB3' ' A' ' 91' ' ' GLN . 16.7 mm -109.19 144.96 16.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 72.209999999999994 111.133 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -97.76 177.5 5.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 72.219999999999999 111.141 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ppt_? -65.35 -40.7 93.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 65.239999999999995 110.872 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -38.06 89.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 65.200000000000003 110.889 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.605 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -76.11 -37.7 57.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 72.140000000000001 110.93 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.61 -36.26 78.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 111.089 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -67.83 -53.06 29.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.158 -0.474 . . . . 71.340000000000003 110.913 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.09 -35.0 79.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 72.420000000000002 110.82 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.17 -36.02 82.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 70.530000000000001 110.94 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.588 HD12 ' CB ' ' A' ' 121' ' ' SER . 2.6 mm? -103.19 43.44 1.08 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.18 -0.464 . . . . 71.409999999999997 110.951 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.494 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.27 -60.12 4.41 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.776 0.798 . . . . 73.420000000000002 110.914 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.74 123.32 9.99 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.627 2.218 . . . . 72.540000000000006 112.388 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.78 118.14 5.5 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.72 2.28 . . . . 63.340000000000003 112.297 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -155.01 111.08 3.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 73.010000000000005 110.884 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.631 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -63.16 112.69 2.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.068 -0.515 . . . . 65.319999999999993 111.154 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.97 -6.94 6.43 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.809 -0.71 . . . . 61.009999999999998 112.556 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.458 HD12 ' O ' ' A' ' 169' ' ' LYS . 2.4 tp -90.26 114.6 26.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.842 0.353 . . . . 75.030000000000001 110.835 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.667 ' HB3' HD22 ' A' ' 167' ' ' LEU . 20.2 p90 -126.24 164.34 21.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 74.329999999999998 110.927 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.586 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -161.24 136.45 7.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 63.130000000000003 110.928 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.432 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 86.2 t -110.19 132.84 57.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 72.340000000000003 111.161 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -142.3 149.96 40.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 73.120000000000005 110.846 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.22 124.05 15.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 72.530000000000001 110.911 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.8 m -60.02 112.6 1.94 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 61.240000000000002 110.857 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.9 m -68.68 -53.29 23.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 75.409999999999997 111.161 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.418 ' CG ' HD12 ' B' ' 310' ' ' ILE . 6.6 m-80 -63.86 -29.45 70.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 54.200000000000003 110.9 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -123.45 97.4 42.45 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.648 0.737 . . . . 72.150000000000006 110.983 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.68 123.85 10.54 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.654 2.236 . . . . 73.219999999999999 112.398 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.61 -14.99 22.26 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.763 -0.732 . . . . 74.430000000000007 112.453 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -116.15 -175.34 2.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.777 0.322 . . . . 62.439999999999998 110.809 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -135.92 156.63 48.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 71.150000000000006 110.95 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 92.3 m -128.05 131.06 49.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 54.140000000000001 111.173 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.01 124.36 43.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.288 -0.415 . . . . 72.409999999999997 110.988 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.9 t -108.44 125.79 52.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 64.049999999999997 110.89 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.1 t -124.86 151.57 30.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.239999999999995 111.195 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.588 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -101.9 111.24 23.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 74.140000000000001 110.818 -179.834 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.28 89.73 3.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 52.229999999999997 110.93 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 67.97 31.71 5.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 71.329999999999998 110.799 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.94 -14.48 62.71 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.738 -0.744 . . . . 74.319999999999993 112.515 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -88.09 139.79 30.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.839 0.352 . . . . 73.329999999999998 110.941 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.475 HG23 ' HB3' ' B' ' 294' ' ' LEU . 7.3 m -100.44 106.74 19.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 75.239999999999995 111.085 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -95.77 121.31 37.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 62.509999999999998 110.949 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -100.75 124.88 47.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 73.510000000000005 110.848 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -112.66 120.24 40.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.169 -0.469 . . . . 73.340000000000003 110.882 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -67.86 133.11 48.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.1 -0.5 . . . . 75.030000000000001 110.91 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 49.7 mt -117.34 107.63 22.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 73.319999999999993 111.129 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.6 ttm -83.01 123.34 29.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 74.25 110.888 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.467 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.07 100.8 8.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.312 -0.404 . . . . 73.109999999999999 110.949 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -136.36 142.5 43.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 75.400000000000006 110.801 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.17 35.99 25.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 75.519999999999996 111.114 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.4 t 60.33 29.76 19.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.239 -0.437 . . . . 72.099999999999994 110.811 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -136.31 140.99 43.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 74.140000000000001 110.873 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.581 HD21 ' HG ' ' A' ' 149' ' ' LEU . 5.0 mp -101.93 153.72 19.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 64.030000000000001 110.915 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.59 139.21 2.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.48 . . . . 71.209999999999994 110.863 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.449 HD12 ' CZ ' ' A' ' 156' ' ' TYR . 50.1 mt -115.5 -28.9 2.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 71.010000000000005 111.108 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -101.14 -5.32 25.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.161 -0.472 . . . . 71.030000000000001 110.873 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 63.63 14.62 8.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 70.319999999999993 110.835 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -119.42 -19.74 8.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.446 . . . . 74.030000000000001 110.918 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -133.7 104.3 6.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.108 -0.497 . . . . 64.530000000000001 111.128 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -94.04 144.87 25.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.218 -0.447 . . . . 75.239999999999995 110.9 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -113.04 175.08 5.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.124 -0.489 . . . . 73.109999999999999 110.874 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -96.02 -16.91 21.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.141 -0.481 . . . . 61.340000000000003 110.861 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -173.77 158.82 3.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 52.299999999999997 110.893 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.581 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.9 OUTLIER -51.5 -36.31 44.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 74.329999999999998 110.935 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.9 ttp -52.29 -51.39 58.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 52.5 110.902 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.0 -39.63 90.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 75.450000000000003 110.944 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.67 -53.41 56.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 74.140000000000001 110.907 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.509 HG13 HD12 ' A' ' 167' ' ' LEU . 69.4 t -61.5 -36.7 74.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 74.109999999999999 111.118 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -54.99 -40.27 69.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 74.030000000000001 110.903 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.21 -52.3 17.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 73.140000000000001 110.891 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.676 ' CD1' HD13 ' A' ' 163' ' ' LEU . 63.1 m-85 -62.72 -17.15 60.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 74.340000000000003 110.94 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.3 m -87.44 -32.79 19.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.085 -0.507 . . . . 63.030000000000001 111.126 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 19.3 m -77.46 -21.56 52.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.254 -0.43 . . . . 72.230000000000004 111.182 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.74 176.35 4.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 74.319999999999993 110.832 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.88 -58.13 6.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 65.140000000000001 111.111 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.81 19.68 8.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 72.150000000000006 110.855 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 162' ' ' GLY . . . . . 0.846 ' HA3' HG23 ' B' ' 317' ' ' VAL . . . 116.66 -8.45 17.14 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.742 -0.742 . . . . 64.409999999999997 112.423 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.676 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.1 mp -94.5 148.06 22.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.863 0.363 . . . . 75.230000000000004 110.869 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 22.1 p -54.35 -27.25 34.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 75.319999999999993 110.983 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.504 HG21 HG22 ' A' ' 101' ' ' THR . 14.7 t -159.55 133.74 7.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.126 -0.488 . . . . 62.549999999999997 111.101 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.3 ptt-85 -53.93 173.14 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 72.329999999999998 110.91 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.667 HD22 ' HB3' ' A' ' 104' ' ' PHE . 15.0 mt -93.82 141.73 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 71.510000000000005 110.895 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.631 HD12 ' O ' ' A' ' 101' ' ' THR . 30.4 mt -125.41 -51.19 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.194 -0.457 . . . . 64.230000000000004 111.213 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 169' ' ' LYS . . . . . 0.458 ' O ' HD12 ' A' ' 103' ' ' LEU . 8.3 mmtt -128.81 122.4 21.47 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.563 0.697 . . . . 73.310000000000002 110.886 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 138.41 37.56 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.635 2.223 . . . . 73.230000000000004 112.352 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.81 84.55 0.31 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 63.130000000000003 110.899 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.1 m -64.32 135.28 28.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 74.230000000000004 111.1 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.5 mtm . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 65.010000000000005 110.847 179.87 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.475 ' HB3' HG23 ' A' ' 126' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.79 0.328 . . . . 73.409999999999997 110.896 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -91.64 88.56 6.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 53.100000000000001 110.883 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -77.91 126.78 31.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 72.239999999999995 110.912 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -123.77 128.26 49.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.094 -0.503 . . . . 62.210000000000001 110.879 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 5.8 m -88.99 165.24 14.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 74.439999999999998 110.92 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -59.53 -19.16 46.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 53.219999999999999 110.886 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -37.01 82.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 74.129999999999995 110.887 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -104.28 -21.1 13.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 64.510000000000005 110.854 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.49 ' HB2' HD11 ' B' ' 305' ' ' LEU . 3.6 m-20 -141.57 77.22 19.63 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.618 0.723 . . . . 74.140000000000001 110.813 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -6.76 19.37 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.732 2.288 . . . . 75.319999999999993 112.328 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 10.4 t -93.79 27.45 2.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.192 -0.458 . . . . 63.039999999999999 111.152 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' B' ' 302' ' ' ASP . 48.3 mt -100.84 136.96 39.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.192 -0.458 . . . . 75.319999999999993 110.89 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.592 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.6 t -108.84 174.35 5.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 75.129999999999995 111.183 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -50.26 -35.37 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.254 -0.43 . . . . 71.129999999999995 110.847 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 308' ' ' GLU . . . . . 0.42 ' H ' HG23 ' B' ' 306' ' ' THR . 1.2 tm-20 -63.16 -46.88 85.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.131 -0.486 . . . . 73.219999999999999 110.935 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.592 ' HG2' HG22 ' B' ' 306' ' ' THR . 11.6 mm-40 -68.4 -47.58 66.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.137 -0.483 . . . . 72.329999999999998 110.889 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.418 HD12 ' CG ' ' A' ' 111' ' ' ASN . 44.2 mm -56.03 -45.41 80.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 75.219999999999999 111.124 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 59.0 p -76.67 -15.86 59.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 70.150000000000006 110.859 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -74.92 -17.27 60.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.499 . . . . 62.509999999999998 111.066 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.5 ptp . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 32.109999999999999 110.875 179.971 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 13.7 t . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.851 0.358 . . . . 62.350000000000001 110.808 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.1 p 67.28 131.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 73.349999999999994 110.894 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.846 HG23 ' HA3' ' A' ' 162' ' ' GLY . 2.1 p -48.59 130.88 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.131 -0.486 . . . . 63.219999999999999 111.112 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -146.72 74.65 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 64.239999999999995 110.868 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.7 mttt . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 121.582 0.706 . . . . 74.239999999999995 110.847 179.934 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.158 0 CA-C-O 120.75 0.229 . . . . 73.099999999999994 112.319 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.406 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 41.5 p-90 -102.18 -26.15 13.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.23 -0.441 . . . . 74.430000000000007 110.893 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -96.01 99.7 11.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 75.129999999999995 110.857 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.8 m-70 -75.63 -36.68 60.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 65.019999999999996 110.926 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.71 27.36 58.83 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.703 -0.761 . . . . 61.350000000000001 112.52 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.46 63.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.83 0.348 . . . . 74.409999999999997 110.973 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 15.3 mm -126.76 144.0 38.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.468 . . . . 62.219999999999999 111.13 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.466 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -93.93 171.83 8.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.209999999999994 111.173 179.906 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.466 ' H ' HG22 ' A' ' 88' ' ' THR . 6.6 ppt_? -63.32 -38.24 90.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 74.420000000000002 110.839 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -76.63 -30.84 57.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 73.439999999999998 110.991 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -70.9 -43.28 68.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.099 -0.501 . . . . 74.030000000000001 110.957 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.472 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -72.72 -37.26 67.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 74.439999999999998 111.152 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.79 -53.1 62.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 71.420000000000002 110.906 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -33.91 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 71.329999999999998 110.841 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 92' ' ' ALA . 9.8 mt -54.69 -38.23 66.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 52.329999999999998 110.925 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.662 HD21 HD23 ' A' ' 105' ' ' LEU . 3.7 mm? -100.33 43.5 1.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.22 -0.446 . . . . 73.209999999999994 110.92 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.501 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -64.32 -59.94 9.75 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.678 0.751 . . . . 74.099999999999994 110.941 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.4 Cg_endo -69.68 123.15 9.84 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.64 2.227 . . . . 61.240000000000002 112.394 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.67 116.56 4.61 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 122.667 2.245 . . . . 74.219999999999999 112.37 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -154.99 108.76 2.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.43 . . . . 61.210000000000001 110.901 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.0 OUTLIER -61.61 111.93 2.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 62.200000000000003 111.15 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.66 -6.82 6.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.731 -0.747 . . . . 64.420000000000002 112.511 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 tp -89.73 111.95 23.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.836 0.351 . . . . 71.439999999999998 110.899 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.406 ' CD2' HD13 ' A' ' 167' ' ' LEU . 23.7 p90 -124.05 167.94 13.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 74.450000000000003 110.878 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.662 HD23 HD21 ' A' ' 96' ' ' LEU . 0.9 OUTLIER -164.67 135.22 4.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 74.409999999999997 110.915 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.406 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 88.6 t -110.25 138.35 38.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.472 . . . . 72.109999999999999 111.074 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -150.66 154.32 37.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.096 -0.502 . . . . 74.319999999999993 110.851 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -51.85 124.39 12.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 63.539999999999999 110.92 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.9 m -63.84 113.39 3.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.226 -0.443 . . . . 73.129999999999995 110.861 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.6 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.1 m -68.9 -56.35 8.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.109 -0.496 . . . . 65.209999999999994 111.173 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.603 ' CG ' HD12 ' B' ' 310' ' ' ILE . 23.2 m-80 -68.67 -23.86 64.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 64.439999999999998 110.942 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -115.42 94.77 40.88 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.693 0.759 . . . . 74.150000000000006 111.004 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 109.94 2.43 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.659 2.24 . . . . 73.129999999999995 112.372 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.43 3.49 24.04 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.723 -0.751 . . . . 72.239999999999995 112.536 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -129.4 -175.84 3.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.819 0.342 . . . . 71.0 110.92 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -135.93 144.87 45.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 74.209999999999994 110.948 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.7 m -108.58 141.59 40.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 71.439999999999998 111.144 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.529 ' CD2' HD11 ' A' ' 163' ' ' LEU . 0.4 OUTLIER -114.79 107.98 16.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 71.129999999999995 110.891 179.989 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 119' ' ' CYS . . . . . 0.564 ' SG ' HG13 ' A' ' 126' ' ' VAL . 10.5 t -93.07 134.9 34.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 61.340000000000003 110.878 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.0 t -138.07 148.35 25.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 63.420000000000002 111.126 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.653 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -100.51 111.64 23.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 61.509999999999998 110.905 -179.869 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -113.86 91.49 3.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.142 -0.481 . . . . 71.120000000000005 110.856 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 66.38 31.55 8.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 74.239999999999995 110.913 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.98 -13.28 63.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.741 -0.742 . . . . 52.43 112.544 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -87.96 140.0 29.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.799 0.333 . . . . 72.150000000000006 110.887 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.564 HG13 ' SG ' ' A' ' 119' ' ' CYS . 57.7 t -98.77 108.15 21.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 75.420000000000002 111.13 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -101.67 128.52 47.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 74.439999999999998 110.909 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 -105.41 125.04 50.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 75.340000000000003 110.874 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.615 ' CE1' HD13 ' A' ' 163' ' ' LEU . 49.3 m-85 -112.71 116.72 30.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.469 . . . . 60.229999999999997 110.909 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.22 137.19 44.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.125 -0.489 . . . . 72.310000000000002 110.811 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.451 HG12 HD11 ' A' ' 140' ' ' ILE . 39.8 mt -118.17 109.59 27.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 72.329999999999998 111.093 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.85 124.19 28.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 71.5 110.94 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.482 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -113.39 98.19 6.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.24 -0.436 . . . . 71.140000000000001 110.917 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -131.51 142.6 49.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.051 -0.522 . . . . 72.310000000000002 110.862 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.98 35.97 26.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.222 -0.445 . . . . 63.310000000000002 111.107 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 61.08 30.24 19.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 63.030000000000001 110.906 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -134.82 141.09 46.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.094 -0.503 . . . . 72.299999999999997 110.917 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.532 HD21 ' HG ' ' A' ' 149' ' ' LEU . 4.9 mp -102.39 149.52 24.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.442 . . . . 74.219999999999999 110.892 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 14.0 t -166.9 137.8 3.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 63.350000000000001 110.861 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.645 HG22 HG13 ' B' ' 317' ' ' VAL . 53.2 mt -115.7 -32.16 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.51 . . . . 73.409999999999997 111.16 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.572 ' CB ' HG21 ' B' ' 317' ' ' VAL . 49.3 t0 -97.39 10.6 39.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 71.230000000000004 110.89 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 9.7 pt-20 45.96 29.89 0.82 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.157 -0.474 . . . . 71.409999999999997 110.888 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -132.51 -40.08 1.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 73.420000000000002 110.867 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.445 ' O ' HG13 ' A' ' 144' ' ' VAL . 2.7 p -116.28 104.62 16.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 73.239999999999995 111.11 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -93.41 150.75 20.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 72.310000000000002 110.952 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' PHE . . . . . 0.474 ' CD1' HD12 ' A' ' 152' ' ' LEU . 44.8 m-85 -121.08 178.2 4.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.193 -0.458 . . . . 74.219999999999999 110.896 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -100.37 -16.08 17.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 75.25 110.891 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.476 ' C ' HD13 ' A' ' 138' ' ' LEU . 1.2 t30 -164.88 172.5 12.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 64.340000000000003 110.853 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.532 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.5 OUTLIER -74.6 -27.55 60.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 70.319999999999993 110.893 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.7 -57.21 14.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 61.100000000000001 110.85 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -66.04 -36.36 83.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 63.32 110.951 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.474 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.63 -49.52 72.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.208 -0.451 . . . . 75.310000000000002 110.926 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.616 HG13 HD12 ' A' ' 167' ' ' LEU . 71.3 t -63.42 -38.36 81.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 75.409999999999997 111.121 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.99 -39.35 68.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 73.140000000000001 110.844 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -71.42 -44.55 64.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 74.239999999999995 110.817 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -68.26 -20.81 64.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 64.239999999999995 110.925 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 67.2 m -84.66 -30.39 24.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 53.340000000000003 111.161 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 13.2 m -79.68 -25.12 41.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.268 -0.424 . . . . 64.349999999999994 111.123 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -162.27 155.48 20.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 74.510000000000005 110.898 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' ALA . . . . . 0.455 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -51.35 -58.4 6.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 73.400000000000006 111.089 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 51.77 29.81 6.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 73.540000000000006 110.876 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 120.57 -14.7 9.92 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.735 -0.745 . . . . 62.140000000000001 112.462 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.615 HD13 ' CE1' ' A' ' 129' ' ' TYR . 4.0 mm? -88.13 136.9 32.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.915 0.388 . . . . 74.340000000000003 110.939 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 164' ' ' CYS . . . . . 0.424 ' SG ' HG22 ' A' ' 165' ' ' THR . 19.3 p -53.86 -26.46 24.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 53.310000000000002 110.851 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.424 HG22 ' SG ' ' A' ' 164' ' ' CYS . 10.2 t -157.58 127.55 6.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 72.0 111.151 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -54.98 140.44 37.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 75.349999999999994 110.841 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.616 HD12 HG13 ' A' ' 153' ' ' VAL . 8.1 mt -60.31 141.44 56.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.464 . . . . 71.340000000000003 110.901 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 101' ' ' THR . 24.2 mt -126.97 -51.41 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 63.240000000000002 111.081 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -131.68 124.27 19.8 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.538 0.685 . . . . 75.0 110.922 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.89 136.65 33.17 Favored 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.664 2.243 . . . . 73.519999999999996 112.296 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.73 85.0 0.31 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 61.210000000000001 110.89 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 25.2 m -64.12 133.17 29.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 73.319999999999993 111.118 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 28.4 mtp . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 60.32 110.911 179.921 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.454 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.828 0.347 . . . . 64.120000000000005 110.934 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.83 88.82 6.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 74.140000000000001 110.86 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -77.82 147.52 35.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 72.129999999999995 111.006 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.19 129.23 19.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 62.520000000000003 110.859 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 298' ' ' SER . . . . . 0.6 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -93.27 160.12 14.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 73.140000000000001 110.817 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 -61.82 -17.26 55.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 75.019999999999996 110.953 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -37.13 84.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 63.340000000000003 110.909 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -97.99 -19.17 18.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 62.329999999999998 110.915 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.528 ' HB2' HD11 ' B' ' 305' ' ' LEU . 34.4 m-20 -150.98 80.08 6.74 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.608 0.718 . . . . 75.299999999999997 110.872 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 -6.58 18.94 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.652 2.234 . . . . 72.25 112.348 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.7 t -94.06 27.45 2.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 73.329999999999998 111.049 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.528 HD11 ' HB2' ' B' ' 302' ' ' ASP . 46.2 mt -100.81 136.84 40.03 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.267 -0.424 . . . . 75.109999999999999 110.959 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.594 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.8 t -105.56 171.0 7.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 73.209999999999994 111.093 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -49.57 -35.42 20.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 61.310000000000002 110.848 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -61.38 -47.78 84.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.152 -0.476 . . . . 72.420000000000002 110.903 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.594 ' HG2' HG22 ' B' ' 306' ' ' THR . 9.7 mm-40 -67.97 -52.08 39.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 73.420000000000002 110.84 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.603 HD12 ' CG ' ' A' ' 111' ' ' ASN . 40.2 mm -56.65 -53.52 40.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 72.099999999999994 111.183 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 84.1 p -57.28 -29.85 64.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 52.229999999999997 110.789 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -69.91 -10.25 57.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 72.450000000000003 111.101 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 64.040000000000006 110.854 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 24.3 p . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.883 0.373 . . . . 53.329999999999998 110.873 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.11 151.61 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 71.430000000000007 110.884 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.645 HG13 HG22 ' A' ' 140' ' ' ILE . 5.7 m -55.89 122.89 5.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.17 -0.468 . . . . 75.510000000000005 111.143 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -131.34 74.63 1.6 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 60.109999999999999 110.846 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 121.546 0.688 . . . . 74.310000000000002 110.886 179.866 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 N--CA 1.466 -0.147 0 CA-C-O 120.795 0.248 . . . . 71.340000000000003 112.382 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.474 ' CH2' HG21 ' A' ' 153' ' ' VAL . 50.1 p-90 -54.76 -26.67 35.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 73.239999999999995 110.893 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -88.0 100.65 13.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.295 -0.411 . . . . 74.129999999999995 110.888 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -75.68 -38.39 58.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.488 . . . . 72.230000000000004 110.883 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.68 18.84 40.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.799 -0.715 . . . . 73.120000000000005 112.473 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.72 81.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.775 0.322 . . . . 75.420000000000002 110.884 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.615 HG23 ' HB3' ' A' ' 91' ' ' GLN . 29.3 mm -147.1 145.16 19.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.245 -0.434 . . . . 74.420000000000002 111.145 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -97.82 177.29 5.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 65.140000000000001 111.132 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -38.86 89.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 61.43 110.905 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -37.68 88.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.246 -0.434 . . . . 72.540000000000006 110.973 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.615 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -76.35 -37.06 57.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.077 -0.511 . . . . 70.219999999999999 110.966 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.37 -33.79 65.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 71.129999999999995 111.132 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -67.74 -53.09 30.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 73.0 110.923 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.16 -39.26 94.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 73.439999999999998 110.853 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.504 HD22 ' HE2' ' A' ' 171' ' ' LYS . 15.1 mt -58.97 -37.57 77.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 72.120000000000005 110.942 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.649 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -100.88 43.07 1.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.442 . . . . 75.420000000000002 110.902 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.496 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -70.01 -59.92 3.98 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.668 0.747 . . . . 74.230000000000004 110.924 -179.978 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.0 Cg_endo -69.74 124.05 10.71 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.771 2.314 . . . . 74.109999999999999 112.309 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 117.32 5.01 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.648 2.232 . . . . 74.420000000000002 112.407 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -155.09 102.6 2.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 62.509999999999998 110.884 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.668 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.2 OUTLIER -56.03 111.51 0.96 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 71.340000000000003 111.142 -179.926 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 131.28 -10.5 5.59 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.755 -0.736 . . . . 60.520000000000003 112.47 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -86.71 111.64 20.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.823 0.344 . . . . 63.149999999999999 110.933 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.418 ' HB2' HD11 ' A' ' 118' ' ' LEU . 21.0 p90 -124.2 162.38 23.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 70.450000000000003 110.888 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.644 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -159.11 135.76 9.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 75.099999999999994 110.931 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 93.1 t -109.9 134.71 51.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.221 -0.445 . . . . 54.009999999999998 111.078 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 7.5 ptt85 -148.27 141.67 25.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.451 . . . . 74.140000000000001 110.941 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -51.29 128.65 22.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 52.329999999999998 110.906 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.23 116.87 3.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 74.310000000000002 110.861 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.511 HG21 ' HG2' ' B' ' 300' ' ' GLU . 9.8 m -70.23 -26.28 63.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 52.420000000000002 111.121 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -106.68 -0.91 23.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.2 -0.455 . . . . 71.340000000000003 110.946 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.415 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 0.6 OUTLIER -139.95 90.41 10.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.641 0.734 . . . . 70.310000000000002 110.969 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 54.2 Cg_endo -69.75 118.34 5.62 Favored 'Trans proline' 0 C--N 1.34 0.131 0 C-N-CA 122.648 2.232 . . . . 74.200000000000003 112.345 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 114.19 -14.68 21.03 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.777 -0.725 . . . . 65.209999999999994 112.533 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -120.14 158.84 26.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.783 0.325 . . . . 74.310000000000002 110.911 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -113.86 149.32 35.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 72.340000000000003 110.886 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.5 m -125.48 124.51 41.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 51.219999999999999 111.125 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.523 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.4 OUTLIER -96.38 134.39 39.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 70.109999999999999 110.957 179.924 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 48.8 t -116.94 127.06 53.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.455 . . . . 53.520000000000003 110.934 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.523 ' CG2' HD21 ' A' ' 118' ' ' LEU . 14.7 t -123.68 152.82 29.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.46 . . . . 70.420000000000002 111.097 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.649 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -104.39 112.13 25.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 52.420000000000002 110.883 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.76 95.7 5.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 60.539999999999999 110.915 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 67.68 28.55 7.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.465 . . . . 75.439999999999998 110.938 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.74 -14.39 63.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.746 -0.74 . . . . 45.140000000000001 112.51 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 142.45 27.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.37 . . . . 72.120000000000005 110.897 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.554 ' O ' HD13 ' B' ' 294' ' ' LEU . 12.1 m -100.57 114.28 38.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.476 . . . . 72.540000000000006 111.185 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -104.69 123.79 48.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 72.019999999999996 110.855 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -100.52 129.17 46.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.484 . . . . 51.229999999999997 110.873 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.425 ' HB3' HD13 ' A' ' 140' ' ' ILE . 62.3 m-85 -117.94 104.01 10.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.186 -0.461 . . . . 64.319999999999993 110.901 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.552 ' O ' HG23 ' A' ' 140' ' ' ILE . 0.1 OUTLIER -58.02 140.18 52.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 71.230000000000004 110.905 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.411 HG12 HD11 ' A' ' 140' ' ' ILE . 44.2 mt -124.97 109.39 22.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 71.0 111.083 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.65 131.7 36.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 70.450000000000003 110.832 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.451 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -117.62 102.4 9.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.24 -0.436 . . . . 73.540000000000006 110.898 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -138.76 142.59 38.8 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 75.310000000000002 110.833 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 59.06 35.96 24.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 32.43 111.117 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 59.88 31.14 20.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.431 . . . . 62.25 110.835 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -137.8 143.16 40.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.468 . . . . 74.430000000000007 110.954 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.451 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 3.7 mp -105.57 152.18 23.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 64.099999999999994 110.946 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 43.9 t -169.91 141.65 2.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 61.32 110.837 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.552 HG23 ' O ' ' A' ' 130' ' ' ARG . 44.5 mt -113.31 -36.39 2.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 74.329999999999998 111.175 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.804 ' HB3' HG21 ' B' ' 317' ' ' VAL . 9.0 p30 -87.9 -1.57 58.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 62.210000000000001 110.886 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 61.07 17.38 7.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 74.040000000000006 110.812 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -126.19 -32.29 2.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 74.109999999999999 110.902 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -114.03 104.85 17.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.491 . . . . 74.140000000000001 111.068 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -97.63 144.35 27.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 62.240000000000002 110.886 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -117.72 171.58 7.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 73.310000000000002 110.892 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.23 -15.45 31.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 72.099999999999994 110.914 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -175.27 158.65 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 75.299999999999997 110.919 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.433 ' N ' HD13 ' A' ' 138' ' ' LEU . 1.0 OUTLIER -51.43 -36.73 45.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.467 . . . . 74.019999999999996 110.897 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.1 ttt -51.84 -50.17 61.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 72.319999999999993 110.956 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.89 -41.6 82.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 73.420000000000002 110.925 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -47.38 77.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 71.150000000000006 110.918 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.474 HG21 ' CH2' ' A' ' 82' ' ' TRP . 89.7 t -63.77 -38.03 81.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 64.209999999999994 111.074 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -57.86 -38.33 75.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.137 -0.483 . . . . 74.200000000000003 110.852 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.81 -48.16 48.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 64.450000000000003 110.858 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.45 ' CD1' HD13 ' A' ' 163' ' ' LEU . 47.2 m-85 -67.02 -20.12 65.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 64.409999999999997 110.95 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 77.9 m -84.91 -30.07 24.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 64.409999999999997 111.167 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 72.3 m -79.69 -25.01 41.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.147 -0.479 . . . . 65.400000000000006 111.193 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.68 167.35 25.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 71.439999999999998 110.836 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.11 -57.88 7.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 54.109999999999999 111.109 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.09 17.45 9.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 55.240000000000002 110.882 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.55 15.92 9.89 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.756 -0.735 . . . . 63.299999999999997 112.451 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.45 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.8 mp -112.19 137.64 50.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.894 0.378 . . . . 63.119999999999997 110.935 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 23.7 t -51.51 -30.13 19.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.178 -0.465 . . . . 73.010000000000005 110.89 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.604 ' HB ' HG22 ' A' ' 101' ' ' THR . 2.6 t -151.45 120.47 6.68 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.176 -0.466 . . . . 73.239999999999995 111.101 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.09 151.81 4.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 75.239999999999995 110.897 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.439 ' CD1' HG13 ' A' ' 153' ' ' VAL . 6.4 mt -67.56 133.85 50.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.184 -0.462 . . . . 72.420000000000002 110.878 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.668 HD12 ' O ' ' A' ' 101' ' ' THR . 24.7 mt -127.03 -51.32 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 73.400000000000006 111.129 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -126.66 120.29 23.04 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.602 0.715 . . . . 75.129999999999995 110.911 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 135.08 29.52 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.677 2.251 . . . . 75.349999999999994 112.273 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 171' ' ' LYS . . . . . 0.504 ' HE2' HD22 ' A' ' 95' ' ' LEU . 0.3 OUTLIER -69.02 84.75 0.34 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 75.25 110.879 179.897 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 19.1 t -64.38 140.58 19.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 74.5 111.143 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 3.8 ptt? . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 65.439999999999998 110.882 179.968 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.554 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.816 0.341 . . . . 71.200000000000003 110.883 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.21 88.14 2.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.207 -0.451 . . . . 74.239999999999995 110.853 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -85.26 149.16 25.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.501 . . . . 65.25 110.888 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.32 128.69 16.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.14 -0.482 . . . . 74.329999999999998 110.93 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.39 158.71 18.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 73.200000000000003 110.862 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 28.2 mtt180 -58.12 -20.27 39.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 64.230000000000004 110.895 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 300' ' ' GLU . . . . . 0.511 ' HG2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -61.94 -36.5 81.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 75.319999999999993 110.884 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -99.32 -24.69 14.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.463 . . . . 73.010000000000005 110.926 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -143.69 79.16 13.81 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.663 0.744 . . . . 73.049999999999997 110.828 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 -5.69 16.78 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.661 2.241 . . . . 72.340000000000003 112.394 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.7 t -92.48 27.44 2.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 71.310000000000002 111.205 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 22.8 mt -102.9 136.71 42.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.462 . . . . 42.530000000000001 110.925 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.637 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.7 t -105.65 173.49 6.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 71.150000000000006 111.172 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -49.9 -37.4 31.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 71.340000000000003 110.84 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 34.6 tp10 -60.92 -52.14 66.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 65.510000000000005 110.932 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.637 ' HG2' HG22 ' B' ' 306' ' ' THR . 9.2 mm-40 -65.11 -51.94 58.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.07 -0.513 . . . . 74.140000000000001 110.916 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 45.5 mm -55.88 -54.35 27.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 63.399999999999999 111.122 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 50.6 m -62.85 -18.48 62.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 41.439999999999998 110.876 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -80.16 1.18 29.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 74.319999999999993 111.091 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 4.1 mtm . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.441 . . . . 73.209999999999994 110.957 179.934 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 38.1 t . . . . . 0 CA--C 1.527 0.072 0 CA-C-O 120.851 0.358 . . . . 61.219999999999999 110.828 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 65.21 149.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 72.099999999999994 110.841 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.804 HG21 ' HB3' ' A' ' 141' ' ' ASP . 13.5 m -62.17 125.99 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 72.049999999999997 111.172 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -140.39 82.89 1.88 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 54.530000000000001 110.879 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.575 0.702 . . . . 42.119999999999997 110.912 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.465 -0.191 0 CA-C-O 120.815 0.256 . . . . 72.530000000000001 112.381 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.442 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 41.1 p-90 -102.28 -30.39 11.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.230000000000004 110.908 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -84.93 101.1 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 74.329999999999998 110.819 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.7 m80 -75.84 -37.5 58.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 75.109999999999999 110.848 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.55 18.62 38.28 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.774 -0.727 . . . . 54.130000000000003 112.52 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.92 80.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.812 0.339 . . . . 72.010000000000005 110.93 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 16.7 mm -141.42 144.29 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 75.209999999999994 111.085 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 m -98.7 160.42 14.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.15 -0.477 . . . . 63.140000000000001 111.168 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.83 -41.05 61.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.243 -0.435 . . . . 73.209999999999994 110.827 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -69.67 -36.0 75.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.257 -0.429 . . . . 70.329999999999998 110.902 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -70.28 -41.92 72.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 70.140000000000001 110.824 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.93 -33.85 59.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 45.240000000000002 111.1 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -58.81 -52.29 66.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 73.430000000000007 110.838 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.68 -37.36 79.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 64.049999999999997 110.866 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.3 mt -55.04 -38.29 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 63.409999999999997 110.94 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.67 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -100.32 43.61 1.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.447 . . . . 72.120000000000005 110.867 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.48 -60.13 5.13 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.68 0.752 . . . . 73.319999999999993 110.929 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.0 Cg_endo -69.76 123.43 10.09 Favored 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.696 2.264 . . . . 74.099999999999994 112.311 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.85 117.89 5.36 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.693 2.262 . . . . 72.030000000000001 112.308 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.82 104.95 2.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 75.209999999999994 110.864 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 168' ' ' ILE . 5.0 p -57.99 111.95 1.34 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.095 -0.502 . . . . 51.43 111.132 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.52 -6.24 6.25 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.744 -0.741 . . . . 41.439999999999998 112.55 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.73 112.62 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 73.25 110.913 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -123.96 166.55 15.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 73.530000000000001 110.915 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.598 HD23 HD21 ' A' ' 96' ' ' LEU . 0.9 OUTLIER -162.0 136.53 6.9 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 63.329999999999998 110.903 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.442 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 86.1 t -110.05 140.35 29.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 72.540000000000006 111.101 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -153.63 146.58 24.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 63.119999999999997 110.866 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -50.79 123.92 10.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.16 -0.473 . . . . 75.25 110.899 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.4 m -59.67 113.48 2.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 74.540000000000006 110.848 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.61 HG21 ' HB2' ' B' ' 298' ' ' SER . 2.2 m -68.55 -55.87 10.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 70.439999999999998 111.143 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -63.67 -29.26 70.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 61.409999999999997 110.934 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.429 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 1.2 m-85 -119.38 97.69 50.26 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.691 0.758 . . . . 72.329999999999998 110.884 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.6 Cg_endo -69.72 117.68 5.22 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.677 2.252 . . . . 73.340000000000003 112.347 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.61 -2.78 24.75 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.74 -0.743 . . . . 53.25 112.482 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -122.75 -176.33 3.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.866 0.365 . . . . 54.25 110.808 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -135.24 142.53 46.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 73.430000000000007 110.869 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.5 m -109.64 137.79 46.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.127 -0.488 . . . . 70.030000000000001 111.166 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.84 114.68 28.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 63.200000000000003 110.932 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.2 t -100.82 129.95 46.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 74.340000000000003 110.844 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.9 t -131.29 150.43 34.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 73.120000000000005 111.101 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.67 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -102.92 111.44 23.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.466 . . . . 74.329999999999998 110.828 -179.835 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.02 92.38 3.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.088 -0.506 . . . . 61.329999999999998 110.876 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 66.61 30.8 8.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 74.099999999999994 110.926 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 98.25 -13.64 62.99 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.727 -0.749 . . . . 73.299999999999997 112.535 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.78 140.02 29.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.855 0.359 . . . . 64.219999999999999 110.939 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.45 ' O ' HD22 ' B' ' 294' ' ' LEU . 6.7 m -101.3 105.53 17.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.266 -0.424 . . . . 63.409999999999997 111.082 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -97.11 129.67 44.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 74.340000000000003 110.855 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -106.66 124.3 49.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 73.109999999999999 110.845 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -111.96 102.98 11.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.261 -0.427 . . . . 65.540000000000006 110.95 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -59.68 140.09 56.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 71.200000000000003 110.859 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.501 HG12 HD11 ' A' ' 140' ' ' ILE . 42.2 mt -120.45 109.01 24.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.468 . . . . 63.130000000000003 111.147 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.38 130.45 40.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 75.109999999999999 110.884 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -116.74 113.51 22.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.232 -0.44 . . . . 73.239999999999995 110.886 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -146.26 136.89 24.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 74.400000000000006 110.829 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.15 35.85 23.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 75.099999999999994 111.043 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.32 30.53 15.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.269 -0.423 . . . . 62.310000000000002 110.829 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -130.6 138.28 50.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 75.510000000000005 110.933 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.57 HD21 ' HG ' ' A' ' 149' ' ' LEU . 3.7 mp -101.16 150.47 22.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 110.915 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -168.38 134.97 1.96 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 63.32 110.827 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.501 HD11 HG12 ' A' ' 131' ' ' ILE . 51.8 mt -113.32 -40.66 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 72.219999999999999 111.107 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.771 ' HB3' HG21 ' B' ' 317' ' ' VAL . 15.9 p30 -84.49 -5.64 59.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 64.209999999999994 110.919 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 61.57 16.29 7.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.109999999999999 110.853 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -125.36 -8.15 6.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 64.230000000000004 110.897 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 6.0 t -144.35 104.5 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 63.420000000000002 111.102 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -94.76 146.77 23.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.148 -0.478 . . . . 72.329999999999998 110.902 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -117.33 176.15 5.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 63.439999999999998 110.911 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -100.44 -14.56 18.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 73.120000000000005 110.861 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' ASN . . . . . 0.421 ' C ' HD13 ' A' ' 138' ' ' LEU . 1.9 t30 -167.05 171.87 10.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 74.340000000000003 110.918 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.57 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.6 OUTLIER -74.49 -22.72 58.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.15 -0.477 . . . . 53.340000000000003 110.907 179.95 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.2 ttt -61.58 -56.76 16.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 53.299999999999997 110.912 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -67.18 -36.3 81.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 70.329999999999998 110.943 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.26 -53.15 59.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 61.119999999999997 110.931 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.451 HG13 ' CD1' ' A' ' 167' ' ' LEU . 65.3 t -62.2 -36.74 76.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 53.340000000000003 111.14 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -54.78 -39.76 68.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.069 -0.514 . . . . 64.439999999999998 110.933 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -71.75 -49.01 42.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.13 -0.486 . . . . 73.239999999999995 110.838 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.408 ' CD1' HD13 ' A' ' 163' ' ' LEU . 38.3 m-85 -62.92 -23.67 67.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.233 -0.44 . . . . 71.109999999999999 110.939 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.553 ' OG1' HD12 ' A' ' 167' ' ' LEU . 94.1 m -83.96 -29.47 27.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.082 -0.508 . . . . 63.329999999999998 111.155 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 42.3 m -77.65 -23.52 49.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 71.109999999999999 111.164 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -165.24 160.17 18.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.205 -0.452 . . . . 71.439999999999998 110.857 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.91 -58.12 6.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 62.240000000000002 111.157 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 21.5 t70 55.87 25.11 8.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 71.219999999999999 110.834 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 118.73 -10.86 12.29 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.792 -0.718 . . . . 44.43 112.441 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.408 HD13 ' CD1' ' A' ' 156' ' ' TYR . 10.8 mp -87.21 138.66 31.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.87 0.367 . . . . 63.0 110.85 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 164' ' ' CYS . . . . . 0.465 ' SG ' HG22 ' A' ' 165' ' ' THR . 18.4 p -54.6 -26.31 31.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 71.129999999999995 110.936 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.465 HG22 ' SG ' ' A' ' 164' ' ' CYS . 9.2 t -157.54 124.98 5.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.133 -0.485 . . . . 61.119999999999997 111.128 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -52.66 147.9 7.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 71.299999999999997 110.815 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.553 HD12 ' OG1' ' A' ' 157' ' ' THR . 7.5 mt -65.93 138.83 58.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.1 -0.5 . . . . 74.340000000000003 110.915 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 101' ' ' THR . 24.9 mt -127.16 -51.29 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 63.450000000000003 111.094 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -129.93 122.25 20.3 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.531 0.681 . . . . 74.230000000000004 110.873 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.86 138.95 38.69 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.689 2.259 . . . . 52.530000000000001 112.287 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 84.13 0.42 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 64.299999999999997 110.85 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 15.2 m -64.37 130.75 29.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 53.43 111.12 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.310000000000002 110.845 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.45 HD22 ' O ' ' A' ' 126' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.764 0.316 . . . . 73.409999999999997 110.876 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.4 m -100.47 88.74 3.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 72.129999999999995 110.894 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -83.53 147.27 27.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 73.319999999999993 110.97 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.1 128.82 21.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.114 -0.493 . . . . 72.319999999999993 110.937 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 298' ' ' SER . . . . . 0.61 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -87.87 156.09 19.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 73.549999999999997 110.893 -179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -60.85 -18.0 53.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.459 . . . . 73.329999999999998 110.853 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.2 -39.05 86.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 74.430000000000007 110.848 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -92.5 -20.49 20.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 74.219999999999999 110.878 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.487 ' HB2' HD11 ' B' ' 305' ' ' LEU . 30.2 m-20 -148.84 81.36 7.71 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.674 0.749 . . . . 74.450000000000003 110.902 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -6.84 19.53 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.711 2.274 . . . . 74.439999999999998 112.374 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.3 t -94.13 27.3 2.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.205 -0.452 . . . . 70.420000000000002 111.097 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.632 HD13 ' OE2' ' B' ' 309' ' ' GLU . 62.2 mt -100.4 136.7 39.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.264 -0.425 . . . . 74.010000000000005 110.914 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.461 HG23 ' H ' ' B' ' 309' ' ' GLU . 7.2 t -93.82 152.99 18.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.454 . . . . 74.519999999999996 111.142 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -49.1 -31.83 8.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 65.230000000000004 110.9 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.77 -54.97 40.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 60.520000000000003 110.881 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.632 ' OE2' HD13 ' B' ' 305' ' ' LEU . 0.3 OUTLIER -57.15 -32.41 66.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 70.120000000000005 110.935 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.635 ' HA ' ' HE2' ' B' ' 313' ' ' MET . 27.0 mm -63.31 -53.2 48.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 65.340000000000003 111.099 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.33 -21.26 63.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 70.25 110.868 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -76.88 -3.13 37.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.499 . . . . 62.039999999999999 111.139 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 313' ' ' MET . . . . . 0.635 ' HE2' ' HA ' ' B' ' 310' ' ' ILE . 2.6 mtm . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 72.349999999999994 110.822 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 43.9 t . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.837 0.351 . . . . 31.32 110.812 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 65.94 145.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 71.409999999999997 110.86 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.771 HG21 ' HB3' ' A' ' 141' ' ' ASP . 6.7 m -56.63 116.29 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 61.240000000000002 111.139 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -125.21 74.89 1.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 75.349999999999994 110.88 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 13.3 mtmt . . . . . 0 C--N 1.328 -0.348 0 CA-C-O 121.652 0.739 . . . . 74.510000000000005 110.919 179.906 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.159 0 CA-C-O 120.784 0.243 . . . . 75.25 112.323 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.42 ' CH2' HG21 ' A' ' 153' ' ' VAL . 34.2 p-90 -101.51 -30.9 11.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 73.239999999999995 110.908 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -87.32 99.48 12.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 75.010000000000005 110.851 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -75.71 -33.64 60.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 74.129999999999995 110.909 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.95 19.59 37.93 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.738 -0.744 . . . . 72.319999999999993 112.449 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.08 82.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.77 0.319 . . . . 75.510000000000005 110.919 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.625 HG23 ' HB3' ' A' ' 91' ' ' GLN . 29.5 mm -146.8 145.04 19.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 72.230000000000004 111.158 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.2 p -101.14 177.34 4.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 62.039999999999999 111.096 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -41.08 97.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 63.299999999999997 110.82 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -62.91 -38.26 90.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 72.540000000000006 110.938 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.625 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -75.73 -36.23 60.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.105 -0.498 . . . . 63.030000000000001 110.962 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.41 -33.83 67.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 73.040000000000006 111.101 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -68.69 -53.14 24.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 63.210000000000001 110.878 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.17 -40.03 96.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 64.450000000000003 110.856 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 91' ' ' GLN . 14.9 mt -58.63 -38.2 77.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 73.310000000000002 110.911 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.645 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -101.42 43.36 1.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 75.420000000000002 110.852 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.29 -60.13 4.39 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.68 0.752 . . . . 72.349999999999994 110.902 179.924 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.4 Cg_endo -69.72 124.08 10.75 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.615 2.21 . . . . 70.329999999999998 112.445 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 116.92 4.78 Favored 'Trans proline' 0 C--O 1.23 0.124 0 C-N-CA 122.704 2.269 . . . . 54.229999999999997 112.325 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -154.79 110.58 3.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 62.130000000000003 110.863 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.638 ' O ' HD12 ' A' ' 168' ' ' ILE . 1.1 p -62.71 111.8 2.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 63.310000000000002 111.114 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.76 -7.07 6.17 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.74 -0.743 . . . . 72.120000000000005 112.443 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.453 HD21 ' HE3' ' A' ' 171' ' ' LYS . 3.0 tp -89.51 111.59 22.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 73.540000000000006 110.969 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.469 ' HB3' HD22 ' A' ' 167' ' ' LEU . 19.6 p90 -123.31 167.7 13.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.213 -0.449 . . . . 74.420000000000002 110.885 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.586 HD23 HD21 ' A' ' 96' ' ' LEU . 1.0 OUTLIER -162.45 134.02 5.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 45.299999999999997 110.873 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.2 t -110.03 140.04 30.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 74.510000000000005 111.067 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.5 151.65 29.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 74.349999999999994 110.884 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -51.38 124.24 11.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 70.099999999999994 110.904 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.6 m -59.17 112.05 1.57 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 53.100000000000001 110.86 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.601 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.3 m -68.77 -56.46 7.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 61.130000000000003 111.126 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.43 ' CG ' HD12 ' B' ' 310' ' ' ILE . 30.8 m-80 -67.26 -24.99 65.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 62.100000000000001 110.915 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -116.42 95.43 45.51 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.69 0.757 . . . . 75.450000000000003 110.896 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 110.52 2.58 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.66 2.24 . . . . 63.240000000000002 112.353 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.7 6.31 21.41 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.707 -0.759 . . . . 42.140000000000001 112.461 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -132.44 -177.81 4.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.797 0.332 . . . . 71.549999999999997 110.841 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -129.01 155.83 44.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 70.010000000000005 110.88 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.9 m -125.84 139.94 53.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.07 -0.514 . . . . 75.140000000000001 111.123 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.71 115.01 26.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.197 -0.456 . . . . 72.310000000000002 110.931 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.6 t -100.83 126.97 47.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.420000000000002 110.889 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.4 t -127.81 153.28 36.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 74.409999999999997 111.127 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.645 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -104.24 111.76 24.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.461 . . . . 72.030000000000001 110.823 -179.787 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.47 92.37 3.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 44.409999999999997 110.844 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 66.95 31.25 7.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 65.019999999999996 110.89 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.71 -14.48 62.99 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.739 -0.743 . . . . 64.310000000000002 112.511 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -87.56 143.38 27.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.796 0.331 . . . . 61.119999999999997 110.916 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.587 ' O ' HD13 ' B' ' 294' ' ' LEU . 9.9 m -103.8 112.97 39.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 71.409999999999997 111.12 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.5 pm0 -105.54 126.56 52.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 70.409999999999997 110.913 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -103.33 126.46 50.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.171 -0.468 . . . . 73.319999999999993 110.854 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.433 ' HB3' HD13 ' A' ' 140' ' ' ILE . 32.0 m-85 -110.49 116.17 30.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 71.400000000000006 110.87 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.645 ' O ' HG23 ' A' ' 140' ' ' ILE . 0.0 OUTLIER -70.04 136.92 50.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.102 -0.499 . . . . 75.230000000000004 110.885 179.99 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.426 HG12 HD11 ' A' ' 140' ' ' ILE . 81.2 mt -118.61 109.28 26.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 52.109999999999999 111.101 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.11 130.41 39.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 73.420000000000002 110.853 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -114.09 116.67 29.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 74.129999999999995 110.878 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -150.35 136.07 18.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 72.319999999999993 110.852 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.11 35.93 23.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.198 -0.456 . . . . 60.130000000000003 111.108 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.71 29.98 14.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 63.25 110.889 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -129.29 142.24 50.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 72.129999999999995 110.887 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.589 HD21 ' HG ' ' A' ' 149' ' ' LEU . 2.1 mp -106.09 148.62 27.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 71.530000000000001 110.966 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.2 t -166.95 131.29 1.97 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.226 -0.443 . . . . 74.530000000000001 110.899 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.645 HG23 ' O ' ' A' ' 130' ' ' ARG . 41.0 mt -107.48 -32.25 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 64.409999999999997 111.13 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.471 ' HA ' HG21 ' B' ' 317' ' ' VAL . 35.6 t0 -86.59 -1.17 57.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 71.299999999999997 110.845 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 60.64 17.85 7.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 60.020000000000003 110.849 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -132.46 -38.43 1.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 70.239999999999995 110.961 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.0 t -104.49 104.55 17.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.075 -0.511 . . . . 72.010000000000005 111.109 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -98.78 146.02 26.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.18 -0.463 . . . . 75.200000000000003 110.95 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -116.71 178.25 4.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 73.150000000000006 110.895 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.5 -15.87 17.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.173 -0.467 . . . . 74.200000000000003 110.905 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -165.81 171.89 12.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 74.209999999999994 110.869 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.589 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.6 OUTLIER -75.05 -22.8 58.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 73.340000000000003 110.909 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -56.76 13.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 74.25 110.875 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -65.86 -35.2 79.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 53.539999999999999 110.913 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.35 -52.69 62.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 61.5 110.975 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.488 HG13 ' CD1' ' A' ' 167' ' ' LEU . 75.0 t -62.67 -36.61 76.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 73.129999999999995 111.126 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -55.02 -39.29 68.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.117 -0.492 . . . . 74.340000000000003 110.887 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.97 -45.99 58.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 74.340000000000003 110.887 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.424 ' CD1' HD13 ' A' ' 163' ' ' LEU . 36.2 m-85 -65.63 -23.68 66.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 64.209999999999994 110.99 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 87.3 m -84.14 -28.94 27.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 74.409999999999997 111.131 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 29.1 m -77.67 -26.21 50.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 61.130000000000003 111.163 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -165.03 162.85 20.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 71.340000000000003 110.892 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.99 -58.4 6.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 52.210000000000001 111.126 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 32.0 t70 57.93 21.69 7.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 72.409999999999997 110.876 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.27 7.33 21.11 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.803 -0.713 . . . . 44.439999999999998 112.518 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.424 HD13 ' CD1' ' A' ' 156' ' ' TYR . 7.8 mp -100.66 138.92 37.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.787 0.327 . . . . 73.409999999999997 110.959 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 36.1 t -51.35 -30.8 19.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 41.310000000000002 110.889 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 9.5 t -158.47 126.17 5.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 74.239999999999995 111.184 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -51.69 152.41 2.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 71.430000000000007 110.823 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.488 ' CD1' HG13 ' A' ' 153' ' ' VAL . 9.9 mt -74.33 139.04 43.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 63.020000000000003 110.847 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.638 HD12 ' O ' ' A' ' 101' ' ' THR . 26.1 mt -127.14 -51.18 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 65.109999999999999 111.124 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 169' ' ' LYS . . . . . 0.408 ' O ' HD12 ' A' ' 103' ' ' LEU . 4.1 mtmt -130.19 119.44 18.69 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.596 0.712 . . . . 73.430000000000007 110.831 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 140.76 43.39 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.716 2.277 . . . . 72.319999999999993 112.287 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 171' ' ' LYS . . . . . 0.453 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -69.65 83.76 0.44 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.163 -0.472 . . . . 64.010000000000005 110.899 179.895 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 30.2 m -64.45 126.28 22.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 74.310000000000002 111.154 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.4 mtm . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 61.210000000000001 110.894 179.949 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.587 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.832 0.348 . . . . 63.149999999999999 110.895 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.74 91.07 8.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 72.299999999999997 110.865 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -79.85 149.59 30.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 73.430000000000007 110.907 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -144.34 129.18 18.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.067 -0.515 . . . . 72.329999999999998 110.944 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 298' ' ' SER . . . . . 0.601 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -94.89 158.37 15.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 74.510000000000005 110.905 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -62.75 -16.64 58.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.181 -0.463 . . . . 74.200000000000003 110.871 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -39.28 90.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 71.25 110.852 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -90.61 -25.38 20.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 64.129999999999995 110.812 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.494 ' HB2' HD11 ' B' ' 305' ' ' LEU . 12.5 m-20 -147.03 84.97 7.14 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.627 0.727 . . . . 72.540000000000006 110.882 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.76 -6.6 19.0 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.699 2.266 . . . . 75.150000000000006 112.367 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.2 t -94.39 27.36 2.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 74.219999999999999 111.149 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.643 HD13 ' OE2' ' B' ' 309' ' ' GLU . 57.3 mt -101.11 136.83 40.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 72.219999999999999 110.879 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.461 HG23 ' H ' ' B' ' 309' ' ' GLU . 10.1 t -92.02 152.89 19.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 73.25 111.116 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -49.89 -31.2 11.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 75.540000000000006 110.895 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -54.07 50.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 74.409999999999997 110.865 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.643 ' OE2' HD13 ' B' ' 305' ' ' LEU . 0.3 OUTLIER -58.92 -32.45 69.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 64.109999999999999 110.91 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.43 HD12 ' CG ' ' A' ' 111' ' ' ASN . 30.5 mm -62.08 -53.67 44.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.152 -0.476 . . . . 53.130000000000003 111.076 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 1.1 p -56.9 -30.78 64.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 71.430000000000007 110.926 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -64.39 -15.14 59.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.513 . . . . 60.32 111.108 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 313' ' ' MET . . . . . 0.408 ' HE2' ' HA ' ' B' ' 310' ' ' ILE . 1.6 mtm . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 74.200000000000003 110.925 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 120.843 0.354 . . . . 63.119999999999997 110.829 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.3 156.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 72.340000000000003 110.837 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.471 HG21 ' HA ' ' A' ' 141' ' ' ASP . 5.7 m -51.41 130.09 11.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.06 -0.518 . . . . 60.219999999999999 111.138 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -145.76 75.01 1.41 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.192 -0.458 . . . . 72.430000000000007 110.891 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-O 121.593 0.711 . . . . 73.420000000000002 110.879 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo . . . . . 0 N--CA 1.466 -0.127 0 CA-C-O 120.79 0.246 . . . . 53.229999999999997 112.406 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.466 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 47.6 p-90 -54.83 -25.75 30.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 71.340000000000003 110.919 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -90.66 99.26 12.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 74.140000000000001 110.899 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.6 m80 -75.96 -41.99 49.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.106 -0.497 . . . . 74.329999999999998 110.906 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.54 25.39 55.17 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.731 -0.747 . . . . 72.030000000000001 112.541 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.4 65.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 63.210000000000001 110.875 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.617 HG23 ' HB3' ' A' ' 91' ' ' GLN . 26.8 mm -136.06 145.25 31.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 73.099999999999994 111.084 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.9 p -97.48 177.09 5.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 73.239999999999995 111.15 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -65.98 -39.46 90.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 73.150000000000006 110.822 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.92 -37.63 88.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.261 -0.427 . . . . 71.319999999999993 110.897 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.617 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -76.01 -37.83 58.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.506 . . . . 73.530000000000001 110.904 -179.865 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.57 -33.98 67.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 65.200000000000003 111.118 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -67.14 -53.14 33.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 62.310000000000002 110.886 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -40.06 94.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 72.099999999999994 110.896 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.6 mt -56.41 -38.85 72.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 73.219999999999999 110.95 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.675 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.5 mm? -99.48 43.26 1.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 63.140000000000001 110.902 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.11 -60.04 4.62 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.717 0.77 . . . . 71.310000000000002 110.891 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.5 Cg_endo -69.79 123.99 10.63 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.728 2.286 . . . . 64.349999999999994 112.315 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.65 117.69 5.23 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.706 2.27 . . . . 73.409999999999997 112.38 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -155.12 103.67 2.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 71.129999999999995 110.841 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.657 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -57.33 111.83 1.21 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 72.530000000000001 111.116 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.34 -8.92 5.93 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.761 -0.733 . . . . 32.130000000000003 112.523 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.6 tp -88.07 111.89 22.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.891 0.377 . . . . 71.209999999999994 110.875 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.453 ' HB2' HD11 ' A' ' 118' ' ' LEU . 25.7 p90 -123.54 165.31 17.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 74.430000000000007 110.888 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.624 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -161.58 137.34 7.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.478 . . . . 61.219999999999999 110.883 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.466 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 91.1 t -109.52 129.91 63.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.221 -0.445 . . . . 51.409999999999997 111.15 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.91 137.93 29.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 71.040000000000006 110.946 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.4 126.96 18.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.45 . . . . 73.150000000000006 110.935 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.0 m -55.57 114.01 1.68 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 73.319999999999993 110.794 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 m -70.07 -49.16 53.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.135 -0.484 . . . . 64.340000000000003 111.098 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.458 ' C ' HD21 ' A' ' 111' ' ' ASN . 0.4 OUTLIER -80.16 -3.17 47.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 71.510000000000005 110.932 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.428 ' N ' HD21 ' A' ' 111' ' ' ASN . 2.0 m-85 -139.48 88.6 12.52 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.615 0.721 . . . . 72.129999999999995 110.897 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 122.29 8.98 Favored 'Trans proline' 0 C--N 1.34 0.117 0 C-N-CA 122.679 2.252 . . . . 70.219999999999999 112.341 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.87 -8.21 23.62 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.714 -0.755 . . . . 54.530000000000001 112.567 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -127.94 -179.64 5.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.759 0.314 . . . . 65.299999999999997 110.9 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -130.86 164.33 25.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 73.239999999999995 110.94 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 97.3 m -143.87 128.16 17.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 72.150000000000006 111.138 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.453 HD11 ' HB2' ' A' ' 104' ' ' PHE . 0.3 OUTLIER -97.31 132.75 42.74 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.272 -0.422 . . . . 42.439999999999998 110.917 179.909 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 5.8 m -113.02 126.54 55.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.166 -0.47 . . . . 74.439999999999998 110.908 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.3 t -126.61 152.37 34.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 53.329999999999998 111.116 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.675 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -104.66 111.9 24.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 60.210000000000001 110.87 -179.877 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -115.26 93.04 4.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 25.050000000000001 110.911 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 66.68 31.03 7.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 73.200000000000003 110.887 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.31 -12.87 65.0 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.79 -0.719 . . . . 44.100000000000001 112.491 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.18 139.91 30.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.805 0.336 . . . . 73.519999999999996 110.906 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.528 ' O ' HD13 ' B' ' 294' ' ' LEU . 92.6 t -99.93 111.21 28.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.24 -0.436 . . . . 65.239999999999995 111.21 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -102.89 129.9 49.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 74.099999999999994 110.866 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -105.36 127.28 52.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 74.5 110.824 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.63 ' CZ ' HD13 ' A' ' 163' ' ' LEU . 44.7 m-85 -113.71 111.11 21.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.29 -0.414 . . . . 61.020000000000003 110.93 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -63.32 137.16 58.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.066 -0.516 . . . . 65.310000000000002 110.841 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.468 ' CG2' HD23 ' A' ' 138' ' ' LEU . 54.3 mt -119.66 109.43 26.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.139 -0.482 . . . . 73.420000000000002 111.132 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -84.63 121.4 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.340000000000003 110.954 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.476 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -110.5 98.11 7.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.327 -0.397 . . . . 71.049999999999997 111.013 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -132.03 142.65 49.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.463 . . . . 62.100000000000001 110.844 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.55 35.95 26.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 40.25 111.165 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 12.5 t 61.31 30.12 18.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 65.420000000000002 110.812 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -135.57 143.56 45.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.466 . . . . 75.239999999999995 110.942 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.476 HD21 ' CE2' ' A' ' 133' ' ' TYR . 4.0 mp -106.37 149.8 26.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 63.32 110.966 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.27 140.82 5.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 60.0 110.836 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.479 HG22 HG13 ' B' ' 317' ' ' VAL . 49.8 mt -115.61 -34.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 72.209999999999994 111.148 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.716 ' CB ' HG21 ' B' ' 317' ' ' VAL . 31.6 p-10 -96.65 11.53 35.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 71.239999999999995 110.875 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 6.6 pt-20 45.76 30.73 0.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 74.099999999999994 110.898 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -131.88 -39.96 1.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.112 -0.494 . . . . 70.420000000000002 110.906 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' VAL . . . . . 0.443 ' O ' HG13 ' A' ' 144' ' ' VAL . 2.6 p -116.6 104.51 16.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 61.350000000000001 111.087 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -93.0 148.91 21.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 75.209999999999994 110.957 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -119.4 177.71 4.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 54.229999999999997 110.821 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -100.52 -15.52 17.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 53.340000000000003 110.919 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -165.81 172.12 12.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 64.310000000000002 110.883 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -22.57 59.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 63.109999999999999 110.912 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.2 ttp -62.73 -57.0 12.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.471 . . . . 75.510000000000005 110.84 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -66.17 -35.56 80.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 73.319999999999993 110.948 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.45 -49.9 71.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 74.450000000000003 110.923 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.722 HG13 HD12 ' A' ' 167' ' ' LEU . 73.8 t -64.01 -38.19 81.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.183 -0.462 . . . . 54.049999999999997 111.192 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.84 -38.17 67.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.11 -0.495 . . . . 62.140000000000001 110.926 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.24 -46.1 57.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 71.530000000000001 110.888 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.414 ' CD1' HD23 ' A' ' 163' ' ' LEU . 35.6 m-85 -70.86 -11.28 60.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.217 -0.447 . . . . 73.329999999999998 110.938 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.4 m -92.2 -32.43 15.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.105 -0.498 . . . . 62.439999999999998 111.128 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 5.7 t -80.35 -25.64 39.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.304 -0.407 . . . . 71.510000000000005 111.078 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -157.53 158.06 34.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.304 -0.407 . . . . 75.340000000000003 110.853 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.89 -56.48 12.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 72.430000000000007 111.103 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 58.12 22.63 9.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 74.409999999999997 110.846 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.28 11.17 18.65 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.752 . . . . 62.439999999999998 112.466 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.63 HD13 ' CZ ' ' A' ' 129' ' ' TYR . 3.1 mm? -105.62 134.5 48.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.928 0.394 . . . . 72.230000000000004 110.943 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 23.5 t -51.71 -29.71 19.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.148 -0.478 . . . . 63.5 110.849 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.4 ' HB ' HG22 ' A' ' 101' ' ' THR . 3.0 t -153.03 120.44 5.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 70.5 111.116 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -53.54 143.0 20.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 73.5 110.913 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.722 HD12 HG13 ' A' ' 153' ' ' VAL . 7.7 mt -61.56 135.58 57.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 44.420000000000002 110.888 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.657 HD12 ' O ' ' A' ' 101' ' ' THR . 27.0 mt -127.19 -51.41 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 64.430000000000007 111.117 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.4 120.04 22.01 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.605 0.717 . . . . 73.439999999999998 110.841 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 133.83 26.48 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.699 2.266 . . . . 73.420000000000002 112.302 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.94 83.67 0.49 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 61.399999999999999 110.883 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.8 m -64.55 144.97 14.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 61.32 111.173 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 7.8 ptm . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 71.340000000000003 110.886 179.92 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.845 0.355 . . . . 34.439999999999998 110.915 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 3.3 t -110.17 88.4 2.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 75.349999999999994 110.883 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -83.46 149.43 26.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.211 -0.45 . . . . 65.430000000000007 110.975 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.71 129.39 10.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 75.540000000000006 110.891 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.25 170.89 9.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.209 -0.45 . . . . 55.130000000000003 110.888 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -63.8 -15.58 59.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 72.310000000000002 110.914 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.47 -38.58 91.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 73.340000000000003 110.848 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -104.08 -26.14 12.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.16 -0.473 . . . . 74.109999999999999 110.876 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.515 ' HB2' HD11 ' B' ' 305' ' ' LEU . 31.0 m-20 -138.33 77.8 34.68 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.594 0.712 . . . . 64.319999999999993 110.897 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.73 -6.15 17.89 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.674 2.249 . . . . 64.120000000000005 112.308 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.3 t -93.64 27.27 2.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.434 . . . . 75.420000000000002 111.069 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.515 HD11 ' HB2' ' B' ' 302' ' ' ASP . 36.0 mt -103.11 136.65 42.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.269 -0.423 . . . . 72.5 110.997 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.65 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.7 t -107.12 173.69 6.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.438 . . . . 72.340000000000003 111.171 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 26.8 pt-20 -49.26 -37.63 24.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 72.319999999999993 110.793 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -61.38 -52.0 66.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 74.310000000000002 110.916 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.65 ' HG2' HG22 ' B' ' 306' ' ' THR . 9.1 mm-40 -63.29 -52.45 61.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 53.200000000000003 110.878 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.447 HD13 ' CE ' ' B' ' 313' ' ' MET . 46.2 mm -56.33 -54.06 32.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.468 . . . . 43.130000000000003 111.098 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 22.8 t -60.33 -19.92 57.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 75.310000000000002 110.882 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.0 3.0 28.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.092 -0.504 . . . . 43.25 111.102 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 313' ' ' MET . . . . . 0.447 ' CE ' HD13 ' B' ' 310' ' ' ILE . 1.8 mtm . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 61.539999999999999 110.887 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 16.2 t . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.882 0.372 . . . . 74.120000000000005 110.838 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.44 139.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.475 . . . . 63.329999999999998 110.87 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.716 HG21 ' CB ' ' A' ' 141' ' ' ASP . 5.6 m -50.93 122.24 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 73.420000000000002 111.188 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -131.85 80.88 1.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.932 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.599 0.714 . . . . 71.530000000000001 110.917 179.928 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.466 -0.124 0 CA-C-O 120.764 0.235 . . . . 73.310000000000002 112.324 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.452 ' CH2' HG21 ' A' ' 153' ' ' VAL . 47.1 p-90 -54.54 -27.18 36.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.251 -0.431 . . . . 73.040000000000006 110.899 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -87.45 99.48 12.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 64.409999999999997 110.997 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.5 m80 -75.6 -39.62 57.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.16 -0.473 . . . . 75.299999999999997 110.914 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.65 23.91 38.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.788 -0.72 . . . . 71.0 112.557 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.53 70.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.798 0.332 . . . . 73.310000000000002 110.913 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.626 HG23 ' HB3' ' A' ' 91' ' ' GLN . 26.4 mm -138.95 145.14 28.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.425 . . . . 74.310000000000002 111.152 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.7 p -97.4 177.17 5.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.21 -0.45 . . . . 64.219999999999999 111.154 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -39.33 89.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.221 -0.445 . . . . 73.349999999999994 110.919 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -64.04 -37.54 87.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 71.219999999999999 110.884 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.626 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -76.13 -38.57 56.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 75.129999999999995 110.94 -179.936 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.27 -36.45 79.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 71.129999999999995 111.044 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.61 -53.15 30.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 73.040000000000006 110.88 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.99 -34.51 78.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 73.140000000000001 110.876 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.29 -35.69 81.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 73.25 110.89 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.618 HD12 ' HB3' ' A' ' 121' ' ' SER . 2.4 mm? -104.89 43.74 1.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 73.510000000000005 110.91 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.45 -59.94 5.37 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.604 0.716 . . . . 72.010000000000005 110.919 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.0 Cg_endo -69.81 122.66 9.32 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.647 2.232 . . . . 72.329999999999998 112.307 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 117.61 5.19 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.66 2.24 . . . . 63.210000000000001 112.369 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -154.99 103.48 2.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.196 -0.456 . . . . 75.319999999999993 110.938 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.681 ' O ' HD12 ' A' ' 168' ' ' ILE . 10.8 p -56.14 111.93 1.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.456 . . . . 54.329999999999998 111.186 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.54 -10.8 5.79 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.77 -0.728 . . . . 63.229999999999997 112.546 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -87.8 111.83 21.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.329 . . . . 74.5 110.923 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.454 ' HB3' HD22 ' A' ' 167' ' ' LEU . 23.4 p90 -123.79 162.09 23.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 73.230000000000004 110.889 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.559 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -157.65 136.58 11.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.117 -0.492 . . . . 74.340000000000003 110.985 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.442 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 88.6 t -109.6 139.54 32.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 65.239999999999995 111.23 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.417 ' NH2' HG21 ' A' ' 117' ' ' THR . 0.0 OUTLIER -151.91 144.55 24.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 62.109999999999999 110.805 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.74 124.05 10.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 41.530000000000001 110.926 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.3 m -59.47 118.75 6.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 65.25 110.941 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.643 HG21 ' HB2' ' B' ' 298' ' ' SER . 3.8 m -68.65 -56.38 8.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 75.019999999999996 111.215 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.545 ' CG ' HD12 ' B' ' 310' ' ' ILE . 1.2 m-80 -70.49 -29.21 65.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 70.420000000000002 110.915 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -107.88 92.72 9.42 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.665 0.745 . . . . 73.349999999999994 110.878 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 112.94 3.22 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.612 2.208 . . . . 62.310000000000002 112.399 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.54 -4.84 24.72 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.699 -0.763 . . . . 64.230000000000004 112.499 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -121.17 -178.9 3.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.824 0.345 . . . . 72.230000000000004 110.857 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' TYR . . . . . 0.512 ' HB2' HD12 ' A' ' 131' ' ' ILE . 60.0 m-85 -125.52 171.5 10.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.431 . . . . 73.140000000000001 110.94 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.417 HG21 ' NH2' ' A' ' 107' ' ' ARG . 99.2 m -139.42 122.82 17.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 52.039999999999999 111.126 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.43 112.49 25.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 72.329999999999998 110.89 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 42.9 t -101.33 124.14 46.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 65.329999999999998 110.879 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.8 t -121.75 150.21 25.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 72.450000000000003 111.115 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' SER . . . . . 0.618 ' HB3' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -98.25 110.82 23.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 72.310000000000002 110.895 -179.832 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.04 90.35 3.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.127 -0.488 . . . . 64.430000000000007 110.937 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 66.1 32.78 7.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 74.319999999999993 110.856 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.48 -13.8 63.93 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.758 -0.734 . . . . 72.510000000000005 112.507 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -87.89 146.39 25.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.835 0.35 . . . . 55.119999999999997 110.9 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.658 ' O ' HD13 ' B' ' 294' ' ' LEU . 5.8 m -106.53 104.13 16.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.216 -0.447 . . . . 73.010000000000005 111.13 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -89.47 112.69 23.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 72.430000000000007 110.884 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -92.6 124.85 36.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 73.099999999999994 110.846 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.442 ' HB3' HD13 ' A' ' 140' ' ' ILE . 80.4 m-85 -118.36 106.71 13.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 73.329999999999998 110.93 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 6.7 ttp-105 -70.23 136.77 50.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.056 -0.52 . . . . 61.130000000000003 110.863 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.512 HD12 ' HB2' ' A' ' 116' ' ' TYR . 58.2 mt -110.83 108.42 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 75.5 111.153 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.65 124.79 26.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 64.409999999999997 110.937 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.462 ' CD2' HD21 ' A' ' 138' ' ' LEU . 0.1 OUTLIER -109.53 104.52 13.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 72.329999999999998 110.951 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -144.26 143.25 30.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.477 . . . . 73.109999999999999 110.913 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 60.39 39.93 18.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 63.219999999999999 111.128 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 56.87 24.09 8.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.254 -0.43 . . . . 72.430000000000007 110.843 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 7.3 mtmm -131.47 162.94 29.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.135 -0.484 . . . . 74.230000000000004 110.917 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.462 HD21 ' CD2' ' A' ' 133' ' ' TYR . 1.1 mt -124.52 148.57 47.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.214 -0.448 . . . . 75.040000000000006 110.943 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 7.2 t -166.44 145.75 5.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 64.329999999999998 110.908 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.55 HG22 HG13 ' B' ' 317' ' ' VAL . 56.1 mt -115.58 -28.75 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 73.310000000000002 111.123 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.622 ' HB3' HG21 ' B' ' 317' ' ' VAL . 4.3 p30 -101.25 12.76 36.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 73.040000000000006 110.906 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.441 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 7.1 pt-20 46.9 27.93 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 71.310000000000002 110.906 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -133.12 -37.77 0.97 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.49 . . . . 65.150000000000006 110.899 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 1.4 t -110.65 104.64 17.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.092 -0.503 . . . . 74.129999999999995 111.077 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -97.56 138.05 35.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 72.439999999999998 110.97 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' PHE . . . . . 0.575 ' CD1' HD12 ' A' ' 152' ' ' LEU . 43.8 m-85 -114.43 176.52 5.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 72.010000000000005 110.909 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.58 -14.58 18.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 55.030000000000001 110.904 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -165.51 172.18 12.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 72.109999999999999 110.899 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.614 HD13 HD22 ' A' ' 152' ' ' LEU . 0.1 OUTLIER -74.63 -22.4 58.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 73.120000000000005 110.91 179.988 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -62.73 -57.12 12.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 65.5 110.896 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.53 -36.3 83.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 62.130000000000003 110.976 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.614 HD22 HD13 ' A' ' 149' ' ' LEU . 0.9 OUTLIER -55.21 -53.22 58.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 63.229999999999997 110.932 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.558 HG13 HD12 ' A' ' 167' ' ' LEU . 67.2 t -60.77 -37.52 76.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 75.25 111.11 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -55.06 -39.02 68.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 74.319999999999993 110.832 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -71.78 -46.54 57.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 75.209999999999994 110.884 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.434 ' CD1' HD13 ' A' ' 163' ' ' LEU . 39.1 m-85 -66.37 -21.23 66.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 75.120000000000005 110.885 -179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 92.0 m -84.18 -31.28 25.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 73.129999999999995 111.131 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 61.7 m -78.29 -24.42 46.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 74.400000000000006 111.137 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -165.64 157.84 14.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 74.010000000000005 110.885 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 160' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -51.26 -58.26 6.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 70.310000000000002 111.089 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 53.92 27.54 7.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 71.510000000000005 110.855 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 118.88 3.99 13.13 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 53.409999999999997 112.509 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.464 ' O ' ' HB1' ' A' ' 160' ' ' ALA . 9.5 mp -106.67 140.95 38.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 73.140000000000001 110.871 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 164' ' ' CYS . . . . . 0.436 ' SG ' HG22 ' A' ' 165' ' ' THR . 18.2 p -54.44 -26.38 30.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 51.0 110.885 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.436 HG22 ' SG ' ' A' ' 164' ' ' CYS . 9.0 t -162.64 129.55 3.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 74.409999999999997 111.105 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -53.13 161.39 0.86 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 71.439999999999998 110.777 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.558 HD12 HG13 ' A' ' 153' ' ' VAL . 10.4 mt -79.21 141.41 37.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 65.420000000000002 110.886 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.681 HD12 ' O ' ' A' ' 101' ' ' THR . 23.1 mt -127.18 -51.4 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 75.209999999999994 111.167 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.6 mtpt -130.13 123.18 20.59 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.577 0.703 . . . . 73.340000000000003 110.937 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 138.3 37.6 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.721 2.281 . . . . 61.549999999999997 112.303 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.1 83.62 0.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 73.120000000000005 110.931 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 21.1 t -64.2 136.9 25.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 72.200000000000003 111.089 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.6 ptt? . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 75.349999999999994 110.87 179.888 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.658 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.872 0.367 . . . . 72.420000000000002 110.918 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 6.0 t -102.65 88.83 3.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 74.439999999999998 110.852 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -83.75 147.82 27.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.109 -0.496 . . . . 74.120000000000005 110.942 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -145.56 129.14 17.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.071 -0.513 . . . . 74.120000000000005 110.858 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 298' ' ' SER . . . . . 0.643 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -88.52 162.16 16.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 42.149999999999999 110.917 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -62.2 -16.89 56.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 74.140000000000001 110.838 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -36.88 84.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.434 . . . . 72.040000000000006 110.882 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -98.32 -19.98 17.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.489 . . . . 63.539999999999999 110.87 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.513 ' HB2' HD11 ' B' ' 305' ' ' LEU . 53.1 m-20 -149.39 79.73 8.02 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.559 0.695 . . . . 63.539999999999999 110.791 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 -6.6 18.98 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.754 2.303 . . . . 71.230000000000004 112.315 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.6 t -94.11 27.27 2.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.44 . . . . 64.510000000000005 111.102 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.513 HD11 ' HB2' ' B' ' 302' ' ' ASP . 48.6 mt -100.24 136.92 39.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.225 -0.443 . . . . 62.530000000000001 110.933 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.618 HG22 ' HG2' ' B' ' 309' ' ' GLU . 12.0 t -107.75 174.53 5.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 61.520000000000003 111.133 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -50.07 -37.86 35.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.212 -0.449 . . . . 75.209999999999994 110.84 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -60.95 -49.71 76.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 74.540000000000006 110.925 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.618 ' HG2' HG22 ' B' ' 306' ' ' THR . 20.9 mm-40 -66.69 -51.95 50.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.159 -0.473 . . . . 73.409999999999997 110.945 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.545 HD12 ' CG ' ' A' ' 111' ' ' ASN . 44.6 mm -56.05 -53.75 35.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.119 -0.491 . . . . 64.099999999999994 111.094 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 82.8 p -59.8 -25.24 64.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 74.310000000000002 110.806 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -77.98 -2.66 38.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.48 . . . . 74.200000000000003 111.071 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 70.0 110.895 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.863 0.363 . . . . 73.109999999999999 110.871 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.29 155.65 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 74.420000000000002 110.865 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.622 HG21 ' HB3' ' A' ' 141' ' ' ASP . 4.7 m -51.38 121.31 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 65.420000000000002 111.13 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -135.92 74.96 1.53 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 52.420000000000002 110.797 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 22.1 mttt . . . . . 0 C--N 1.33 -0.275 0 CA-C-O 121.63 0.729 . . . . 62.039999999999999 110.875 179.893 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 C--O 1.231 0.167 0 CA-C-O 120.796 0.248 . . . . 64.230000000000004 112.348 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 82' ' ' TRP . . . . . 0.487 ' CH2' HG21 ' A' ' 153' ' ' VAL . 45.0 p-90 -100.09 -28.25 13.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 75.329999999999998 110.902 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -83.55 102.19 11.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.418 . . . . 74.230000000000004 110.888 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -75.57 -38.65 59.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 64.230000000000004 110.818 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 59.27 18.14 41.38 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.719 -0.753 . . . . 72.230000000000004 112.494 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.96 80.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.68 0.276 . . . . 72.519999999999996 110.871 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.595 HG23 ' HB3' ' A' ' 91' ' ' GLN . 26.5 mm -145.82 145.41 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.321 -0.399 . . . . 74.519999999999996 111.181 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -100.21 176.85 5.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 72.019999999999996 111.156 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -43.29 97.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.22 -0.446 . . . . 71.209999999999994 110.865 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.31 -37.74 78.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 73.209999999999994 110.871 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.595 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -76.51 -38.24 55.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 73.030000000000001 110.847 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.21 -38.47 85.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 63.420000000000002 111.106 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.88 -52.45 50.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 72.329999999999998 110.858 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -33.64 76.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 74.239999999999995 110.862 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 11.7 mt -60.74 -38.0 83.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 74.340000000000003 110.92 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.617 ' CD1' HD23 ' A' ' 105' ' ' LEU . 8.1 mp -105.77 43.18 1.15 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 71.420000000000002 110.891 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -61.39 -59.83 12.37 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.649 0.738 . . . . 74.420000000000002 110.917 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.77 124.2 10.85 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.695 2.263 . . . . 74.329999999999998 112.355 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.79 111.06 2.71 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.694 2.263 . . . . 75.030000000000001 112.273 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -148.99 123.28 9.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 64.430000000000007 110.954 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.687 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -72.97 111.66 8.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 63.030000000000001 111.174 -179.897 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.79 -7.81 6.13 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.786 -0.721 . . . . 63.43 112.47 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -87.4 111.63 21.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.852 0.358 . . . . 62.32 110.98 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -125.33 160.17 29.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 74.400000000000006 110.839 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.617 HD23 ' CD1' ' A' ' 96' ' ' LEU . 1.1 pp -156.09 134.71 11.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.112 -0.495 . . . . 73.319999999999993 110.92 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.518 HG22 HD12 ' A' ' 118' ' ' LEU . 91.9 t -109.52 141.22 25.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.171 -0.468 . . . . 53.409999999999997 111.101 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -153.58 149.94 28.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.474 . . . . 73.530000000000001 110.826 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.81 124.28 10.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.917 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.6 t -57.32 104.93 0.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 61.009999999999998 110.817 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.7 m -68.68 -30.04 68.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 50.229999999999997 111.083 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.656 HD22 HD12 ' B' ' 310' ' ' ILE . 0.1 OUTLIER -74.93 -30.55 61.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 61.350000000000001 110.928 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -139.64 116.09 8.3 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.636 0.731 . . . . 75.25 110.895 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 122.17 8.86 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.676 2.25 . . . . 62.130000000000003 112.349 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.4 -9.73 24.27 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.708 -0.758 . . . . 55.329999999999998 112.54 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -114.53 175.47 5.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.341 . . . . 62.219999999999999 110.871 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -132.57 146.55 51.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 73.329999999999998 110.911 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 3.3 m -116.71 138.84 51.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 74.120000000000005 111.097 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.518 HD12 HG22 ' A' ' 106' ' ' VAL . 0.8 OUTLIER -112.82 115.93 29.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.48 . . . . 73.319999999999993 110.919 179.954 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.4 m -99.87 120.17 39.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.261 -0.427 . . . . 53.25 110.875 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.4 t -121.99 146.97 26.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 65.319999999999993 111.174 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.43 110.45 22.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.229 -0.442 . . . . 75.129999999999995 110.794 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.1 98.05 6.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.092 -0.504 . . . . 75.439999999999998 110.904 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 66.22 28.29 10.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 75.010000000000005 110.86 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.35 -14.91 63.0 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.77 -0.729 . . . . 44.43 112.512 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt -87.58 139.03 30.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.342 . . . . 75.209999999999994 110.986 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.589 ' O ' HD13 ' B' ' 294' ' ' LEU . 11.0 m -99.67 109.68 25.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 71.219999999999999 111.124 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -100.98 130.74 47.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 74.329999999999998 110.826 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -105.9 131.47 53.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 72.049999999999997 110.852 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' TYR . . . . . 0.598 ' HB3' HD13 ' A' ' 140' ' ' ILE . 80.2 m-85 -115.94 115.74 26.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 73.129999999999995 110.892 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -70.55 125.29 26.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.52 . . . . 71.409999999999997 110.865 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.467 HG12 HD11 ' A' ' 140' ' ' ILE . 79.6 mt -107.07 108.9 26.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 60.409999999999997 111.172 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 4.2 ttt -76.27 129.44 36.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.111 -0.495 . . . . 73.200000000000003 110.792 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -111.89 116.65 30.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 74.129999999999995 110.926 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -151.11 135.99 17.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.488 . . . . 72.5 110.846 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.02 35.89 23.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.519999999999996 111.126 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.5 27.16 15.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 70.340000000000003 110.873 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.73 136.07 51.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 64.140000000000001 110.895 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.2 mp -101.52 150.15 23.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.174 -0.466 . . . . 74.099999999999994 110.89 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 53.3 p -167.95 131.81 1.68 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 73.239999999999995 110.895 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.598 HD13 ' HB3' ' A' ' 129' ' ' TYR . 60.7 mt -105.8 -33.5 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 53.340000000000003 111.117 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -85.24 -0.36 54.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 64.319999999999993 110.869 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 60.53 17.72 7.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 62.509999999999998 110.889 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -132.53 -38.55 1.03 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 43.140000000000001 110.932 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.8 t -101.99 104.5 16.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.1 -0.5 . . . . 72.439999999999998 111.166 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -99.87 143.38 30.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 65.25 110.975 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' PHE . . . . . 0.401 ' CE1' HD12 ' A' ' 152' ' ' LEU . 62.1 m-85 -115.82 174.56 5.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 71.310000000000002 110.909 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -100.87 -3.52 29.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 73.219999999999999 110.888 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -176.51 157.87 1.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 74.400000000000006 110.879 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.3 mp -59.18 -44.08 92.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 62.420000000000002 110.953 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -36.25 36.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 52.240000000000002 110.858 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.21 -45.49 40.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 75.230000000000004 110.941 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.401 HD12 ' CE1' ' A' ' 146' ' ' PHE . 0.4 OUTLIER -55.83 -42.52 75.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 61.530000000000001 110.961 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.516 HG13 HD12 ' A' ' 167' ' ' LEU . 75.5 t -66.6 -43.36 90.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 64.400000000000006 111.13 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -52.97 -37.34 61.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 62.520000000000003 110.915 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -72.3 -47.6 48.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 72.299999999999997 110.81 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.494 ' CD1' HD13 ' A' ' 163' ' ' LEU . 42.9 m-85 -68.35 -15.59 63.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 73.140000000000001 110.943 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.3 m -86.76 -33.98 19.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.079 -0.51 . . . . 71.540000000000006 111.135 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 3.9 m -78.08 -25.37 47.6 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 51.329999999999998 111.076 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -157.5 161.67 38.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.244 -0.434 . . . . 74.219999999999999 110.853 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.65 -54.49 22.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 61.310000000000002 111.092 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 59.81 20.46 9.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 64.150000000000006 110.868 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 109.18 12.19 20.53 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.713 -0.756 . . . . 53.439999999999998 112.397 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.494 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.3 mp -105.89 136.93 44.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.794 0.331 . . . . 75.340000000000003 110.965 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 11.5 t -51.57 -29.69 18.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 72.540000000000006 110.812 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.527 ' HB ' HG22 ' A' ' 101' ' ' THR . 1.9 t -152.67 120.24 6.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 64.010000000000005 111.118 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -50.97 146.1 6.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 75.049999999999997 110.901 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.516 HD12 HG13 ' A' ' 153' ' ' VAL . 7.0 mt -63.48 132.17 50.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 71.230000000000004 110.898 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 168' ' ' ILE . . . . . 0.687 HD12 ' O ' ' A' ' 101' ' ' THR . 23.9 mt -126.97 -51.39 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 73.409999999999997 111.184 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.3 mttm -123.87 119.25 26.83 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.54 0.686 . . . . 74.129999999999995 110.843 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 134.78 28.89 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.742 2.295 . . . . 55.240000000000002 112.362 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.99 84.46 0.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 63.549999999999997 110.898 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.7 m -64.42 129.89 28.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.221 -0.445 . . . . 70.420000000000002 111.153 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.6 mtt . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.24 -0.436 . . . . 71.099999999999994 110.914 179.861 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 294' ' ' LEU . . . . . 0.589 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.856 0.36 . . . . 71.140000000000001 110.983 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 6.2 t -82.95 89.07 6.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 70.140000000000001 110.868 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -79.95 148.42 31.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 75.209999999999994 110.917 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.21 128.53 13.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 73.099999999999994 110.935 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 20.3 m -89.57 162.14 15.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.292 -0.413 . . . . 62.130000000000003 110.888 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -59.33 -19.8 49.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 74.120000000000005 110.857 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -36.7 82.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 63.340000000000003 110.852 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -102.58 -10.56 19.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 63.109999999999999 110.933 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 302' ' ' ASP . . . . . 0.524 ' HB2' HD11 ' B' ' 305' ' ' LEU . 44.7 m-20 -157.58 78.6 3.56 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.662 0.744 . . . . 64.530000000000001 110.937 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.64 -6.7 19.17 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.77 2.314 . . . . 75.120000000000005 112.351 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 15.2 t -93.74 27.54 2.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.213 -0.449 . . . . 65.109999999999999 111.168 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 305' ' ' LEU . . . . . 0.524 HD11 ' HB2' ' B' ' 302' ' ' ASP . 44.0 mt -101.74 138.25 38.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 75.409999999999997 110.955 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 306' ' ' THR . . . . . 0.609 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.8 t -107.52 172.97 6.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 74.519999999999996 111.132 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -50.09 -31.98 14.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.451 . . . . 62.149999999999999 110.967 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 308' ' ' GLU . . . . . 0.462 ' H ' HG23 ' B' ' 306' ' ' THR . 0.6 OUTLIER -66.72 -45.8 77.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.099 -0.501 . . . . 44.450000000000003 110.87 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 309' ' ' GLU . . . . . 0.609 ' HG2' HG22 ' B' ' 306' ' ' THR . 19.3 mm-40 -70.31 -51.67 28.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 52.539999999999999 110.872 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 310' ' ' ILE . . . . . 0.656 HD12 HD22 ' A' ' 111' ' ' ASN . 40.5 mm -55.72 -53.09 41.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 60.240000000000002 111.189 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 35.0 t -63.97 -25.62 68.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 71.099999999999994 110.879 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 312' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' B' ' 308' ' ' GLU . . . -71.16 -9.75 58.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 74.109999999999999 111.144 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 72.299999999999997 110.902 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 86.1 p . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.902 0.382 . . . . 73.230000000000004 110.902 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 65.54 147.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 75.140000000000001 110.857 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 317' ' ' VAL . . . . . 0.404 HG23 ' O ' ' B' ' 317' ' ' VAL . 12.3 m -51.23 116.84 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.084 -0.507 . . . . 74.319999999999993 111.164 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -125.24 75.04 1.42 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 64.530000000000001 110.839 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.616 0.722 . . . . 73.25 110.875 179.904 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 CA-C-O 121.428 0.46 . . . . 61.530000000000001 112.477 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -44.99 1.8 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.685 2.257 . . . . 44.009999999999998 112.36 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.55 39.73 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.457 . . . . 70.030000000000001 110.917 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.08 -100.72 0.28 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.712 -0.756 . . . . 50.32 112.485 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 77.7 p -164.29 64.5 0.15 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.832 0.348 . . . . 74.409999999999997 110.871 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -126.32 68.59 66.71 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.652 0.739 . . . . 74.25 110.873 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -33.14 17.42 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.731 2.287 . . . . 75.319999999999993 112.319 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.444 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 48.9 p-90 -54.86 -26.32 34.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 64.140000000000001 110.915 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -89.17 100.55 13.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.27 -0.423 . . . . 71.109999999999999 110.885 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 -75.62 -37.06 60.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 75.540000000000006 110.834 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 56.24 20.56 29.27 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.703 -0.76 . . . . 65.310000000000002 112.501 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.32 79.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.684 0.278 . . . . 64.310000000000002 110.857 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.594 HG23 ' HB3' ' A' ' 91' ' ' GLN . 24.4 mm -144.19 144.82 22.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 75.430000000000007 111.076 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 p -96.57 177.08 5.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 34.439999999999998 111.167 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -66.03 -39.04 89.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.278 -0.419 . . . . 73.549999999999997 110.811 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -69.59 -34.75 74.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 71.299999999999997 110.893 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.594 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.3 OUTLIER -75.34 -36.63 61.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 64.400000000000006 110.899 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.06 -34.0 61.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 64.239999999999995 111.028 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.24 -53.4 37.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.234 -0.439 . . . . 61.5 110.855 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.87 -39.17 93.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 74.439999999999998 110.916 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 17.3 mt -57.5 -38.44 74.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 74.239999999999995 110.913 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.626 HD12 ' CB ' ' A' ' 121' ' ' SER . 2.7 mm? -101.89 43.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 73.340000000000003 110.931 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.487 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.93 -60.35 4.48 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.674 0.75 . . . . 75.340000000000003 110.982 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.71 123.13 9.82 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.735 2.29 . . . . 62.520000000000003 112.341 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 118.08 5.47 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.713 2.275 . . . . 64.340000000000003 112.273 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.89 104.4 2.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.445 . . . . 71.109999999999999 110.888 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 168' ' ' ILE . 2.6 p -56.82 111.93 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.108 -0.496 . . . . 71.409999999999997 111.143 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.85 -8.83 6.09 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.718 -0.753 . . . . 45.240000000000002 112.435 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.7 tp -89.74 111.78 22.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.84 0.352 . . . . 62.0 110.901 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -123.75 163.9 20.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 74.319999999999993 110.857 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.547 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -159.2 136.99 10.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.213 -0.449 . . . . 73.420000000000002 110.918 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.444 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 86.3 t -110.23 137.38 42.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.166 -0.47 . . . . 64.519999999999996 111.125 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -150.69 145.58 25.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 73.349999999999994 110.912 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.5 124.09 11.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 65.329999999999998 110.958 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 t -60.46 114.42 2.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.184 -0.462 . . . . 74.400000000000006 110.851 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.465 HG21 ' HB2' ' B' ' 298' ' ' SER . 2.3 m -68.73 -53.17 23.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 63.229999999999997 111.143 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.634 ' CG ' HD12 ' B' ' 310' ' ' ILE . 37.1 m-80 -63.49 -29.38 70.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 71.409999999999997 110.862 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -125.97 96.11 38.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.667 0.746 . . . . 73.129999999999995 110.947 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.66 127.09 14.17 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.69 2.26 . . . . 73.420000000000002 112.314 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.4 -15.72 22.37 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.72 -0.752 . . . . 51.009999999999998 112.472 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -117.59 179.23 4.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.89 0.376 . . . . 73.150000000000006 110.868 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' TYR . . . . . 0.638 ' CE2' HD21 ' A' ' 149' ' ' LEU . 55.7 m-85 -124.68 162.81 23.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.118 -0.492 . . . . 75.209999999999994 110.924 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.487 HG23 ' HE1' ' B' ' 314' ' ' PTR . 89.8 m -134.72 126.45 29.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.122 -0.49 . . . . 65.510000000000005 111.136 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.23 119.83 37.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 74.230000000000004 110.915 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.5 t -105.94 122.44 46.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 73.040000000000006 110.902 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.7 t -122.67 151.01 26.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.268 -0.423 . . . . 71.530000000000001 111.121 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.626 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -103.54 111.0 23.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 71.409999999999997 110.868 -179.858 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.47 94.59 4.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 71.530000000000001 110.881 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 66.23 29.88 9.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 72.400000000000006 110.905 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.87 -13.17 63.93 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.72 -0.753 . . . . 72.329999999999998 112.492 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -88.01 140.06 29.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.836 0.35 . . . . 73.120000000000005 110.906 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.448 ' O ' HG23 ' A' ' 126' ' ' VAL . 8.8 m -101.25 107.88 22.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 63.130000000000003 111.111 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -97.05 123.05 40.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 74.319999999999993 110.865 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -102.41 125.17 49.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 74.450000000000003 110.895 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -113.01 112.56 24.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 72.420000000000002 110.924 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.37 132.79 48.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.092 -0.504 . . . . 63.420000000000002 110.884 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.523 HG12 HD11 ' A' ' 140' ' ' ILE . 29.3 mt -113.19 110.1 30.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.224 -0.444 . . . . 74.439999999999998 111.18 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.04 128.56 34.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 62.100000000000001 110.904 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.448 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -115.42 101.37 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.411 . . . . 75.010000000000005 110.888 -179.863 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -136.49 142.57 43.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.479 . . . . 74.209999999999994 110.848 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.14 35.96 25.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 73.010000000000005 111.169 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.28 29.6 19.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 73.030000000000001 110.825 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -136.23 142.3 44.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.08 -0.509 . . . . 74.049999999999997 110.905 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.448 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 4.1 mp -103.86 150.06 24.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.25 -0.432 . . . . 70.040000000000006 110.9 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 33.8 t -167.37 140.45 3.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.161 -0.472 . . . . 74.219999999999999 110.846 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.596 HG22 HG13 ' B' ' 317' ' ' VAL . 58.9 mt -115.7 -28.76 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.143 -0.481 . . . . 60.299999999999997 111.125 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.59 ' HA ' HG21 ' B' ' 317' ' ' VAL . 6.1 p30 -95.28 -1.74 50.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 75.140000000000001 110.875 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 61.57 17.03 8.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 64.400000000000006 110.862 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -127.49 -33.99 2.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 35.43 110.882 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -112.21 104.58 17.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.112 -0.494 . . . . 63.32 111.09 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -97.79 143.98 27.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 71.540000000000006 111.01 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.529 ' CD1' HD12 ' A' ' 152' ' ' LEU . 51.3 m-85 -118.55 178.07 4.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 71.200000000000003 110.875 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.55 -15.44 17.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 71.430000000000007 110.859 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -165.39 172.27 12.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.175 -0.466 . . . . 71.019999999999996 110.93 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.638 HD21 ' CE2' ' A' ' 116' ' ' TYR . 0.7 OUTLIER -74.63 -24.78 58.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.168 -0.469 . . . . 75.25 110.909 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.3 tmm? -61.54 -57.09 13.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.271 -0.422 . . . . 61.439999999999998 110.903 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.65 -36.1 82.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 63.310000000000002 110.94 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.529 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.69 -48.27 75.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.439 . . . . 73.049999999999997 110.92 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.52 HG13 HD12 ' A' ' 167' ' ' LEU . 73.6 t -64.84 -37.43 80.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 72.510000000000005 111.19 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -56.1 -38.12 70.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 74.209999999999994 110.887 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.09 -44.33 63.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.47 . . . . 75.5 110.879 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -71.1 -16.14 62.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 62.520000000000003 110.925 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 95.4 m -87.02 -33.3 19.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.501 . . . . 72.340000000000003 111.123 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.4 t -80.52 -24.29 39.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 63.409999999999997 111.153 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -157.47 155.01 29.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 71.129999999999995 110.845 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.18 -57.46 8.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 73.319999999999993 111.102 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 60.01 20.75 9.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 70.010000000000005 110.866 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.78 17.24 7.54 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.756 -0.735 . . . . 75.219999999999999 112.507 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 9.7 mp -111.18 139.13 46.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.833 0.349 . . . . 72.030000000000001 110.935 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 38.4 t -51.37 -31.76 23.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 55.409999999999997 110.904 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 5.3 t -156.02 124.42 5.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 33.140000000000001 111.174 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -51.43 146.87 6.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 73.129999999999995 110.78 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.52 HD12 HG13 ' A' ' 153' ' ' VAL . 7.7 mt -65.74 138.45 57.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.144 -0.48 . . . . 73.340000000000003 110.901 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 101' ' ' THR . 26.4 mt -127.24 -51.31 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.168 -0.469 . . . . 73.209999999999994 111.132 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 1.8 mmtp -129.2 121.98 20.87 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.605 0.717 . . . . 71.400000000000006 110.902 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 138.24 37.6 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.718 2.278 . . . . 62.420000000000002 112.3 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.46 83.36 0.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 65.049999999999997 110.88 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.5 m -64.46 134.91 28.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 63.43 111.148 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.5 ptm . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 51.539999999999999 110.853 179.943 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.374 0 CA-C-O 121.494 0.497 . . . . 45.030000000000001 112.546 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.66 167.86 23.08 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.7 2.267 . . . . 63.219999999999999 112.323 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 10.3 mp -52.94 -42.47 65.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.135 -0.484 . . . . 63.100000000000001 110.884 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 87.53 29.37 21.85 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.7 -0.762 . . . . 73.109999999999999 112.474 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 7.1 t -88.4 57.03 4.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.904 0.383 . . . . 73.209999999999994 110.818 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -131.15 135.75 47.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 62.340000000000003 110.902 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 6.0 mtm180 -100.26 105.85 17.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 62.0 110.883 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -171.04 131.94 0.82 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 75.030000000000001 110.832 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.46 105.54 6.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 73.239999999999995 110.82 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 37.2 p -59.42 -178.95 0.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 73.519999999999996 110.886 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.437 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER -158.05 99.59 1.67 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 62.100000000000001 110.944 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.6 t -96.2 88.95 4.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 53.229999999999997 110.882 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -71.47 147.09 48.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 51.310000000000002 110.869 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.06 129.48 21.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.11 -0.495 . . . . 72.109999999999999 110.869 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 298' ' ' SER . . . . . 0.465 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -93.86 161.29 14.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 33.049999999999997 110.851 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -61.33 -17.74 55.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 74.150000000000006 110.875 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -36.99 84.62 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.132 -0.485 . . . . 73.439999999999998 110.914 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -100.33 -20.61 15.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 74.340000000000003 110.933 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.514 ' HB2' HD11 ' B' ' 305' ' ' LEU . 23.8 m-20 -147.82 79.07 9.52 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.619 0.724 . . . . 63.539999999999999 110.825 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -6.54 18.85 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.678 2.252 . . . . 72.120000000000005 112.35 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.3 t -94.05 27.47 2.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.23 -0.441 . . . . 62.409999999999997 111.129 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' B' ' 302' ' ' ASP . 47.6 mt -100.64 136.94 39.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.247 -0.433 . . . . 72.400000000000006 110.875 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.607 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.2 t -108.96 172.34 6.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 62.409999999999997 111.158 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -48.98 -34.16 12.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.2 -0.455 . . . . 71.0 110.93 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 308' ' ' GLU . . . . . 0.418 ' H ' HG23 ' B' ' 306' ' ' THR . 2.7 mt-10 -64.28 -45.09 89.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 72.319999999999993 110.895 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.607 ' HG2' HG22 ' B' ' 306' ' ' THR . 10.4 mm-40 -74.31 -50.21 19.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.49 . . . . 71.140000000000001 110.847 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.634 HD12 ' CG ' ' A' ' 111' ' ' ASN . 40.6 mm -55.69 -53.05 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 62.420000000000002 111.131 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 25.0 m -62.74 -32.48 73.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 54.109999999999999 110.851 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -62.88 -16.56 59.27 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.146 -0.479 . . . . 75.150000000000006 111.145 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -97.88 14.02 28.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 53.340000000000003 110.905 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.487 ' HE1' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 2.1 t -100.62 -33.19 10.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.117 -1.401 . . . . 74.010000000000005 110.864 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 3.1 m 63.88 158.03 0.08 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 61.229999999999997 110.876 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.596 HG13 HG22 ' A' ' 140' ' ' ILE . 4.7 m -51.61 123.21 2.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.145 -0.479 . . . . 63.439999999999998 111.196 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -137.87 77.67 1.64 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 73.200000000000003 110.852 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -52.27 156.86 2.6 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.534 0.683 . . . . 75.540000000000006 110.957 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.68 112.64 3.12 Favored 'Trans proline' 0 N--CA 1.465 -0.177 0 C-N-CA 122.691 2.261 . . . . 64.420000000000002 112.407 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 CA-C-O 119.138 -0.812 . . . . 71.019999999999996 112.484 179.993 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 CA-C-O 121.477 0.487 . . . . 70.319999999999993 112.512 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -41.69 4.06 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.662 2.242 . . . . 33.240000000000002 112.323 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.4 mt -115.39 -30.8 6.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.22 -0.445 . . . . 74.219999999999999 110.941 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.57 -69.64 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.772 -0.728 . . . . 71.120000000000005 112.519 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.3 t -152.19 60.38 0.84 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 72.129999999999995 110.907 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -134.29 73.88 68.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.646 0.736 . . . . 62.409999999999997 110.859 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -7.97 22.42 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.689 2.26 . . . . 53.409999999999997 112.316 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.415 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 38.0 p-90 -102.76 -30.13 11.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 75.430000000000007 110.871 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -87.42 97.22 10.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 75.420000000000002 110.908 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.2 m80 -75.77 -37.48 59.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 72.019999999999996 110.894 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.7 25.94 56.57 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.704 -0.76 . . . . 54.240000000000002 112.474 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.26 67.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.726 0.298 . . . . 72.209999999999994 110.91 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 15.5 mm -128.41 144.12 38.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 73.209999999999994 111.111 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.459 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -94.87 171.23 8.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.153 -0.476 . . . . 74.329999999999998 111.198 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.459 ' H ' HG22 ' A' ' 88' ' ' THR . 7.1 ppt_? -62.03 -39.08 91.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 74.450000000000003 110.829 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -75.15 -32.8 61.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 55.539999999999999 110.952 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -69.97 -41.38 74.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.161 -0.472 . . . . 73.219999999999999 110.888 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.606 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -74.26 -36.55 63.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 71.340000000000003 111.051 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.64 -53.21 60.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 75.319999999999993 110.887 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.45 -34.08 76.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 71.299999999999997 110.884 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.606 HD12 ' HA ' ' A' ' 92' ' ' ALA . 9.5 mt -54.88 -38.42 67.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 71.140000000000001 110.938 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.775 HD21 HD23 ' A' ' 105' ' ' LEU . 3.9 mm? -100.27 43.57 1.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 70.5 110.894 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.514 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.38 -59.47 4.91 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.712 0.768 . . . . 72.430000000000007 110.902 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 52.7 Cg_endo -69.78 123.74 10.39 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.74 2.294 . . . . 73.109999999999999 112.304 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 115.63 4.19 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.639 2.226 . . . . 73.200000000000003 112.3 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -155.34 121.03 5.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.254 -0.43 . . . . 62.240000000000002 110.871 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.682 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.8 OUTLIER -72.39 111.74 7.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.097 -0.501 . . . . 64.030000000000001 111.128 -179.906 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.28 -4.32 6.76 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.696 -0.764 . . . . 51.240000000000002 112.481 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.544 HD12 ' O ' ' A' ' 169' ' ' LYS . 3.8 tp -90.24 120.92 31.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.908 0.385 . . . . 75.230000000000004 110.895 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.463 ' HB3' HD22 ' A' ' 167' ' ' LEU . 23.7 p90 -133.05 175.94 8.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.118 -0.492 . . . . 65.120000000000005 110.919 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.775 HD23 HD21 ' A' ' 96' ' ' LEU . 0.9 OUTLIER -169.47 134.27 1.43 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 74.25 110.863 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.415 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 84.7 t -110.93 131.4 62.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 34.299999999999997 111.161 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.66 150.81 36.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 74.5 110.863 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -57.5 124.08 17.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 74.530000000000001 110.927 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.5 m -57.94 117.1 3.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 72.310000000000002 110.868 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.9 m -69.01 -56.17 8.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 64.319999999999993 111.071 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -71.97 -26.76 62.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 63.020000000000003 110.913 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -108.42 90.63 7.31 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.655 0.74 . . . . 62.130000000000003 110.922 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 113.56 3.41 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.71 2.273 . . . . 73.030000000000001 112.339 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.44 2.62 24.4 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.704 -0.76 . . . . 73.239999999999995 112.512 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -130.78 -172.62 2.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.82 0.343 . . . . 71.109999999999999 110.853 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -140.52 145.23 36.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 75.239999999999995 110.882 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.407 HG23 ' HE1' ' B' ' 314' ' ' PTR . 31.6 m -108.95 128.22 54.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 64.319999999999993 111.12 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.488 HD23 ' HB2' ' A' ' 129' ' ' TYR . 0.4 OUTLIER -110.86 104.7 13.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 72.219999999999999 110.916 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.3 m -87.21 153.91 21.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.185 -0.461 . . . . 64.040000000000006 110.843 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.633 HG21 HD12 ' A' ' 163' ' ' LEU . 12.8 t -146.58 142.66 20.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 64.120000000000005 111.192 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.62 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.3 OUTLIER -92.13 111.29 22.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 64.549999999999997 110.803 -179.803 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -123.23 93.55 3.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 75.439999999999998 110.905 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 67.5 29.27 7.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 71.329999999999998 110.837 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.68 -19.05 56.18 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.741 -0.742 . . . . 52.100000000000001 112.464 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -87.44 136.68 32.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.851 0.358 . . . . 73.150000000000006 110.891 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.52 ' O ' HD13 ' B' ' 294' ' ' LEU . 4.1 p -97.26 106.73 18.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 74.430000000000007 111.105 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -91.95 120.19 32.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.123 -0.49 . . . . 64.400000000000006 110.924 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -87.79 124.72 33.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 72.430000000000007 110.878 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.686 ' CZ ' HD13 ' A' ' 163' ' ' LEU . 57.0 m-85 -114.14 106.8 14.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 75.400000000000006 110.919 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -64.06 141.28 58.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 73.310000000000002 110.905 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.433 HG21 HD23 ' A' ' 138' ' ' LEU . 61.9 mt -123.25 111.25 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 64.430000000000007 111.13 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.32 125.07 31.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 65.299999999999997 110.862 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.492 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -111.77 98.27 7.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 75.310000000000002 110.947 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -130.83 142.56 50.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 44.439999999999998 110.872 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.2 35.96 25.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 73.140000000000001 111.182 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.44 29.32 18.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.473 . . . . 62.310000000000002 110.861 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mtmm -134.1 139.93 46.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 65.340000000000003 110.91 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.492 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 4.8 mp -102.01 149.21 24.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.271 -0.422 . . . . 70.340000000000003 110.934 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.2 p -165.69 140.57 4.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 71.109999999999999 110.901 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.532 HG22 HG13 ' B' ' 317' ' ' VAL . 50.1 mt -115.56 -32.5 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 73.120000000000005 111.155 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.561 ' HA ' HG21 ' B' ' 317' ' ' VAL . 40.3 t0 -89.64 1.14 56.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 75.420000000000002 110.918 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 60.53 17.81 7.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 74.549999999999997 110.865 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -132.43 -38.59 1.04 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 73.120000000000005 110.88 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.48 104.6 16.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 71.530000000000001 111.104 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -99.95 144.58 28.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 73.120000000000005 110.933 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.482 ' CD1' HD12 ' A' ' 152' ' ' LEU . 57.7 m-85 -117.89 177.77 4.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 74.409999999999997 110.896 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.65 -15.31 17.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 74.319999999999993 110.919 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -166.06 172.13 11.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 75.5 110.933 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.6 -24.45 58.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.202 -0.454 . . . . 73.140000000000001 110.943 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.88 -56.94 14.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 71.109999999999999 110.904 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.95 -35.33 80.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 65.140000000000001 110.917 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.482 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.59 -52.4 63.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.463 . . . . 62.240000000000002 110.924 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.696 HG13 HD12 ' A' ' 167' ' ' LEU . 85.3 t -62.77 -36.63 76.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 44.030000000000001 111.099 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -55.51 -39.09 70.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 41.020000000000003 110.856 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -72.08 -44.18 63.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 64.540000000000006 110.857 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.405 ' CD1' HD23 ' A' ' 163' ' ' LEU . 30.2 m-85 -67.91 -21.94 65.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.445 . . . . 50.119999999999997 110.929 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.529 HG23 ' O ' ' A' ' 167' ' ' LEU . 63.0 m -84.57 -30.2 25.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.081 -0.508 . . . . 71.099999999999994 111.172 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 93.5 m -79.84 -24.01 41.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.191 -0.459 . . . . 75.420000000000002 111.18 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -163.15 159.54 23.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 72.329999999999998 110.835 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.25 -57.99 7.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 73.230000000000004 111.047 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 57.04 24.18 9.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.212 -0.449 . . . . 72.329999999999998 110.891 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 112.75 0.89 25.86 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.707 -0.759 . . . . 75.129999999999995 112.471 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.686 HD13 ' CZ ' ' A' ' 129' ' ' TYR . 4.0 mm? -95.71 136.22 36.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.923 0.392 . . . . 41.439999999999998 110.922 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 49.3 t -51.82 -28.94 17.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.15 -0.477 . . . . 64.239999999999995 110.908 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.2 t -156.97 123.46 4.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.123 -0.489 . . . . 64.5 111.102 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -51.49 139.99 18.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.231 -0.44 . . . . 70.510000000000005 110.892 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.696 HD12 HG13 ' A' ' 153' ' ' VAL . 8.6 mt -62.32 135.81 57.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 73.420000000000002 110.946 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.682 HD12 ' O ' ' A' ' 101' ' ' THR . 29.3 mt -127.05 -51.4 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.431 . . . . 75.129999999999995 111.18 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 169' ' ' LYS . . . . . 0.544 ' O ' HD12 ' A' ' 103' ' ' LEU . 21.3 mttt -126.88 118.29 22.34 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.574 0.702 . . . . 74.239999999999995 110.881 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 138.15 37.15 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.757 2.305 . . . . 73.409999999999997 112.373 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 171' ' ' LYS . . . . . 0.409 ' HD3' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -68.18 84.9 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 55.219999999999999 110.913 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 33.9 m -64.34 138.8 22.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 73.430000000000007 111.174 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.1 ptm . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 74.049999999999997 110.854 179.892 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 CA-C-O 121.474 0.486 . . . . 52.25 112.456 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.71 165.7 30.04 Favored 'Trans proline' 0 N--CA 1.464 -0.207 0 C-N-CA 122.745 2.296 . . . . 70.030000000000001 112.372 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.06 -40.82 64.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.262 -0.427 . . . . 72.540000000000006 110.86 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 91.61 23.09 29.43 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.763 -0.732 . . . . 74.230000000000004 112.47 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 3.2 m -101.84 127.24 48.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.921 0.391 . . . . 64.019999999999996 110.931 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -153.9 173.27 16.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 74.129999999999995 110.914 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.79 115.94 20.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.272 -0.422 . . . . 71.209999999999994 110.804 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -175.45 126.9 0.25 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.12 -0.491 . . . . 62.229999999999997 110.891 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 91.5 p -114.83 89.87 3.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 72.109999999999999 110.834 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 89.1 p -60.29 -172.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 61.32 110.799 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.7 OUTLIER -163.84 103.88 0.91 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 74.25 110.919 179.955 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 28.4 t -92.47 88.65 6.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 73.340000000000003 110.856 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -71.62 147.69 47.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.47 . . . . 70.019999999999996 110.934 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 297' ' ' LYS . . . . . 0.4 ' HB2' ' HE1' ' B' ' 313' ' ' MET . 1.5 mtpp -154.0 129.46 9.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 72.430000000000007 110.921 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.61 175.3 5.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 71.430000000000007 110.887 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 41.8 mtt180 -63.7 -16.0 59.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 75.409999999999997 110.913 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.04 -42.12 98.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 74.030000000000001 110.903 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -103.12 -15.55 16.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 74.319999999999993 110.925 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.528 ' HB2' HD11 ' B' ' 305' ' ' LEU . 5.4 m-20 -151.37 78.16 7.13 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.551 0.691 . . . . 75.109999999999999 110.801 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 -6.28 18.25 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.606 2.204 . . . . 74.540000000000006 112.326 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.7 t -93.4 27.23 2.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 70.329999999999998 111.096 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.528 HD11 ' HB2' ' B' ' 302' ' ' ASP . 36.8 mt -103.48 137.81 41.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.217 -0.447 . . . . 72.030000000000001 110.888 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.606 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -103.48 173.52 6.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 72.129999999999995 111.118 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.87 -35.23 22.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 74.310000000000002 110.838 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 308' ' ' GLU . . . . . 0.409 ' H ' HG23 ' B' ' 306' ' ' THR . 6.0 tt0 -63.28 -48.32 78.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.187 -0.461 . . . . 62.25 110.927 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.606 ' HG2' HG22 ' B' ' 306' ' ' THR . 2.9 mm-40 -66.43 -52.27 48.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 74.109999999999999 110.897 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 45.8 mm -56.82 -45.75 83.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 60.539999999999999 111.12 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 32.6 p -72.5 -15.94 61.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 71.349999999999994 110.904 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -81.98 1.75 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.119 -0.491 . . . . 74.340000000000003 111.115 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 313' ' ' MET . . . . . 0.4 ' HE1' ' HB2' ' B' ' 297' ' ' LYS . 2.3 mtt -115.25 14.51 16.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 72.400000000000006 110.833 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.407 ' HE1' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 27.3 t -115.35 -35.13 4.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.171 -1.377 . . . . 73.439999999999998 110.935 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 6.0 t 65.06 150.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.089 -0.505 . . . . 75.310000000000002 110.9 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.561 HG21 ' HA ' ' A' ' 141' ' ' ASP . 4.3 m -51.64 123.07 2.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.094 -0.503 . . . . 73.25 111.121 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -134.49 75.0 1.56 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.485 . . . . 75.120000000000005 110.875 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.1 mtmp? -55.57 160.55 3.8 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.571 0.7 . . . . 73.129999999999995 110.857 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 111.03 2.71 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.67 2.247 . . . . 74.120000000000005 112.271 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.361 0 CA-C-O 119.126 -0.819 . . . . 62.43 112.509 179.939 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.308 0 CA-C-O 121.424 0.458 . . . . 71.299999999999997 112.515 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 -42.15 3.73 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.673 2.249 . . . . 72.329999999999998 112.374 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.87 28.26 3.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 72.420000000000002 110.958 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.09 -105.89 0.35 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.678 -0.772 . . . . 75.329999999999998 112.454 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 67.6 m -148.93 63.52 1.05 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.882 0.372 . . . . 61.25 110.852 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -138.14 68.32 48.35 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.606 0.717 . . . . 73.219999999999999 110.797 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -32.92 17.7 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.717 2.278 . . . . 72.129999999999995 112.412 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.451 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 49.5 p-90 -54.89 -25.68 30.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 63.340000000000003 110.921 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -90.36 99.22 12.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 73.310000000000002 110.881 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -75.89 -40.69 53.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.119 -0.491 . . . . 72.349999999999994 110.778 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.83 24.84 54.91 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.732 -0.747 . . . . 70.129999999999995 112.512 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.79 65.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.815 0.34 . . . . 62.109999999999999 110.93 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.475 ' CG2' ' HB2' ' A' ' 92' ' ' ALA . 12.3 mm -129.73 144.21 38.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.145 -0.48 . . . . 63.119999999999997 111.081 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.456 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -99.77 177.17 5.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 75.099999999999994 111.175 179.878 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.456 ' H ' HG22 ' A' ' 88' ' ' THR . 2.3 ppt_? -64.59 -40.84 96.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 73.230000000000004 110.88 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -71.53 -34.74 70.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 74.420000000000002 110.869 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -73.29 -42.27 62.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 61.039999999999999 110.882 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 87' ' ' ILE . . . -74.17 -33.81 63.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 74.400000000000006 111.098 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.496 ' OE2' HG21 ' A' ' 126' ' ' VAL . 24.0 mm-40 -62.2 -53.25 57.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 53.439999999999998 110.857 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -35.01 79.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 72.109999999999999 110.843 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 12.9 mt -59.09 -36.19 74.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 74.219999999999999 110.917 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.635 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -104.43 43.48 1.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 61.310000000000002 110.9 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.56 -59.98 5.22 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.675 0.75 . . . . 65.450000000000003 110.94 -179.999 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.5 Cg_endo -69.86 123.51 10.14 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.641 2.227 . . . . 74.530000000000001 112.311 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 117.35 5.03 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.608 2.206 . . . . 62.130000000000003 112.379 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -154.84 115.2 3.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 65.099999999999994 110.863 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.643 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.2 OUTLIER -66.53 111.91 3.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 63.109999999999999 111.2 -179.908 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.5 -6.47 6.26 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.695 -0.764 . . . . 64.010000000000005 112.452 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.6 tp -90.47 111.75 23.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.83 0.347 . . . . 63.020000000000003 110.936 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.501 ' HB3' HD22 ' A' ' 167' ' ' LEU . 22.3 p90 -124.43 163.66 21.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.462 . . . . 71.430000000000007 110.866 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.587 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -159.49 137.11 9.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.478 . . . . 74.310000000000002 110.902 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.451 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 92.2 t -110.22 137.89 40.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 75.129999999999995 111.157 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.71 145.76 26.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.148 -0.478 . . . . 65.019999999999996 110.938 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -51.9 124.22 12.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 61.149999999999999 110.881 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.7 m -58.31 110.96 1.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 61.149999999999999 110.81 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.502 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.8 m -68.82 -54.67 14.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 72.099999999999994 111.161 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.625 ' CG ' HD12 ' B' ' 310' ' ' ILE . 34.2 m-80 -63.72 -27.92 69.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 72.310000000000002 110.859 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.418 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 5.2 m-85 -123.14 95.28 46.05 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.659 0.742 . . . . 74.239999999999995 110.898 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.9 Cg_endo -69.7 122.64 9.33 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.672 2.248 . . . . 73.329999999999998 112.364 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.49 -2.32 24.94 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.745 -0.741 . . . . 55.340000000000003 112.476 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -131.09 -175.94 3.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.856 0.36 . . . . 73.540000000000006 110.822 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -131.54 164.57 25.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 74.319999999999993 110.915 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.429 HG23 ' HE2' ' B' ' 314' ' ' PTR . 98.8 m -135.93 139.48 43.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 53.43 111.134 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.448 HD23 ' CD1' ' A' ' 129' ' ' TYR . 0.4 OUTLIER -109.98 117.18 33.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.199 -0.455 . . . . 75.129999999999995 110.95 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.3 m -101.52 123.93 46.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 71.019999999999996 110.896 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.3 t -123.12 151.72 27.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 73.340000000000003 111.136 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.635 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -101.09 111.59 23.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 73.430000000000007 110.882 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.43 91.04 3.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.13 -0.486 . . . . 72.150000000000006 110.943 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 67.12 30.72 7.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 74.349999999999994 110.826 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.95 -14.83 62.4 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.822 -0.704 . . . . 31.100000000000001 112.505 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.3 ptpt -88.11 140.18 29.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.813 0.34 . . . . 64.140000000000001 110.885 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.519 ' O ' HD22 ' B' ' 294' ' ' LEU . 8.6 m -99.94 108.9 23.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.253 -0.431 . . . . 63.130000000000003 111.085 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -95.9 121.8 38.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 71.549999999999997 110.929 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -99.73 124.67 45.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 65.540000000000006 110.892 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.448 ' CD1' HD23 ' A' ' 118' ' ' LEU . 74.1 m-85 -111.13 117.23 32.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 74.540000000000006 110.92 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -67.64 132.29 47.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 71.349999999999994 110.871 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.457 ' CG2' HD23 ' A' ' 138' ' ' LEU . 55.1 mt -113.56 107.57 23.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 74.120000000000005 111.116 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.9 ttm -83.92 122.56 28.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.19 -0.459 . . . . 62.329999999999998 110.902 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.448 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -111.29 99.4 8.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 53.32 110.913 -179.845 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -133.44 142.54 48.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 75.329999999999998 110.927 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 57.21 35.96 26.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.298 -0.41 . . . . 75.540000000000006 111.126 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.7 t 60.85 28.12 17.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 61.32 110.91 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.12 140.67 45.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 75.230000000000004 110.902 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.457 HD23 ' CG2' ' A' ' 131' ' ' ILE . 4.0 mp -102.2 147.65 26.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 65.530000000000001 110.911 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.95 137.66 5.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 53.039999999999999 110.828 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.502 HG22 HG13 ' B' ' 317' ' ' VAL . 51.0 mt -113.35 -31.93 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 74.239999999999995 111.152 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.564 ' HA ' HG21 ' B' ' 317' ' ' VAL . 40.7 t0 -90.52 1.2 56.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 71.549999999999997 110.894 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 60.62 17.81 7.81 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 60.5 110.899 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -132.43 -38.7 1.04 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 65.420000000000002 110.912 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.27 104.64 16.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 44.229999999999997 111.141 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -100.0 143.26 30.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 73.340000000000003 110.86 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.509 ' CD1' HD12 ' A' ' 152' ' ' LEU . 60.3 m-85 -117.83 175.14 5.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 73.099999999999994 110.87 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.63 -1.91 34.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.505 . . . . 71.230000000000004 110.88 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.425 ' C ' HD13 ' A' ' 138' ' ' LEU . 0.8 OUTLIER -179.31 172.23 1.22 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 71.430000000000007 110.884 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.411 ' O ' HG23 ' A' ' 153' ' ' VAL . 0.7 OUTLIER -75.24 -28.18 59.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 65.349999999999994 110.925 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.0 ttt -58.03 -57.21 13.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 72.25 110.843 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -65.69 -37.31 86.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 73.439999999999998 110.944 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.509 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.4 OUTLIER -55.43 -46.91 76.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 63.32 110.949 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.434 HG13 ' CD1' ' A' ' 167' ' ' LEU . 69.3 t -64.6 -39.47 85.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 75.439999999999998 111.152 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -54.83 -38.72 67.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.103 -0.498 . . . . 73.299999999999997 110.949 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.31 -45.43 63.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 74.129999999999995 110.887 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.426 ' CD1' HD13 ' A' ' 163' ' ' LEU . 31.9 m-85 -67.22 -21.98 65.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 75.450000000000003 110.935 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.424 HG23 ' O ' ' A' ' 167' ' ' LEU . 58.7 m -84.15 -29.95 26.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 73.329999999999998 111.139 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 86.4 m -78.13 -27.0 48.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.203 -0.453 . . . . 61.520000000000003 111.121 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -164.71 155.65 14.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.245 -0.434 . . . . 75.510000000000005 110.838 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.532 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -51.35 -58.2 6.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.135 -0.484 . . . . 75.109999999999999 111.092 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 52.51 28.97 6.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 72.25 110.873 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 121.89 -2.54 10.88 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.712 -0.756 . . . . 74.420000000000002 112.514 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.532 ' O ' ' HB1' ' A' ' 160' ' ' ALA . 9.6 mp -101.62 136.45 41.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.786 0.327 . . . . 72.120000000000005 110.969 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' CYS . . . . . 0.473 ' SG ' HG22 ' A' ' 165' ' ' THR . 19.5 p -54.42 -26.72 32.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.169 -0.469 . . . . 72.140000000000001 110.894 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.473 HG22 ' SG ' ' A' ' 164' ' ' CYS . 9.0 t -157.31 125.09 5.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.103 -0.499 . . . . 70.099999999999994 111.126 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -51.96 164.99 0.23 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 73.340000000000003 110.845 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.501 HD22 ' HB3' ' A' ' 104' ' ' PHE . 11.5 mt -84.58 138.72 32.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 71.400000000000006 110.924 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.643 HD12 ' O ' ' A' ' 101' ' ' THR . 27.7 mt -127.22 -51.22 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 75.030000000000001 111.106 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -128.58 121.22 21.11 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.533 0.682 . . . . 41.32 110.935 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.84 136.99 34.19 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.633 2.222 . . . . 71.140000000000001 112.31 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.41 83.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 74.299999999999997 110.88 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 26.9 m -64.64 133.1 30.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 45.409999999999997 111.136 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 37.6 mtm . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 72.030000000000001 110.822 179.929 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.236 0 CA-C-O 121.423 0.457 . . . . 65.319999999999993 112.464 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 169.48 18.83 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 122.704 2.27 . . . . 73.040000000000006 112.321 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 47.1 mt -56.5 -39.45 73.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.215 -0.448 . . . . 75.040000000000006 110.903 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 102.64 -29.19 13.0 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.797 -0.716 . . . . 61.450000000000003 112.487 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 5.3 m -84.37 137.14 33.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.964 0.411 . . . . 74.319999999999993 110.859 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 3.6 mttp -141.06 178.91 7.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 73.540000000000006 110.911 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.57 93.7 3.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 63.219999999999999 110.854 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -171.81 101.69 0.18 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 71.109999999999999 110.864 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 1.7 t -128.25 137.42 51.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.486 . . . . 72.409999999999997 110.868 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 93.2 p -64.32 -172.02 0.06 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 74.120000000000005 110.91 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.519 HD22 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER -162.95 106.4 1.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 75.030000000000001 110.876 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.25 88.83 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 63.43 110.837 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -72.61 146.9 46.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 75.25 110.904 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -140.82 129.23 22.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.081 -0.509 . . . . 70.510000000000005 110.822 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 298' ' ' SER . . . . . 0.502 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -92.31 156.21 17.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 55.43 110.856 -179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -59.17 -19.37 44.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.092 -0.504 . . . . 72.109999999999999 110.843 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.7 -39.5 88.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 74.420000000000002 110.867 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -96.2 -20.16 18.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.46 . . . . 71.430000000000007 111.017 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.476 ' HB2' HD11 ' B' ' 305' ' ' LEU . 41.9 m-20 -147.34 77.77 10.51 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.596 0.712 . . . . 72.310000000000002 110.888 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -6.37 18.41 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.716 2.277 . . . . 71.239999999999995 112.349 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.2 t -93.79 27.45 2.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.249 -0.432 . . . . 65.040000000000006 111.167 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.476 HD11 ' HB2' ' B' ' 302' ' ' ASP . 42.1 mt -100.56 136.79 39.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 75.340000000000003 110.979 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.621 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -106.45 173.76 6.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 62.340000000000003 111.083 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -49.92 -37.45 31.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 62.229999999999997 110.89 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -60.87 -50.68 72.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 75.109999999999999 110.877 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.621 ' HG2' HG22 ' B' ' 306' ' ' THR . 16.6 mm-40 -66.21 -52.04 51.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 71.340000000000003 110.907 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.625 HD12 ' CG ' ' A' ' 111' ' ' ASN . 44.7 mm -56.04 -53.5 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 73.439999999999998 111.092 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 20.1 m -64.18 -19.05 65.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 73.439999999999998 110.832 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.28 3.79 26.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.101 -0.5 . . . . 35.049999999999997 111.134 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -114.37 14.03 17.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 72.400000000000006 110.818 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.429 ' HE2' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 23.1 t -98.2 -31.63 11.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.111 -1.404 . . . . 72.109999999999999 110.88 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.34 155.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 70.420000000000002 110.866 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.564 HG21 ' HA ' ' A' ' 141' ' ' ASP . 4.3 m -51.74 120.54 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 62.210000000000001 111.145 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -135.43 74.66 1.52 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 75.400000000000006 110.955 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? -58.31 160.43 9.45 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.596 0.712 . . . . 63.340000000000003 110.922 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 113.51 3.39 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.675 2.25 . . . . 74.400000000000006 112.374 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 CA-C-O 119.15 -0.806 . . . . 74.420000000000002 112.565 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 CA-C-O 121.44 0.467 . . . . 54.32 112.451 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -46.11 1.35 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.68 2.253 . . . . 72.200000000000003 112.385 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -135.69 29.1 3.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.45 . . . . 72.109999999999999 110.937 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 154.88 -128.96 2.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.733 -0.746 . . . . 71.329999999999998 112.515 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 66.6 m -137.42 55.0 1.82 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.884 0.374 . . . . 73.140000000000001 110.878 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.35 74.42 80.98 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.57 0.7 . . . . 73.230000000000004 110.869 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.68 -25.77 28.61 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.719 2.279 . . . . 51.409999999999997 112.285 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 46.9 p-90 -54.44 -27.1 34.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.261 -0.427 . . . . 64.439999999999998 110.915 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -86.52 100.83 12.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 73.319999999999993 110.924 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -75.81 -39.42 56.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 73.340000000000003 110.894 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.28 22.7 45.06 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.787 -0.72 . . . . 53.210000000000001 112.495 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 pttt 179.01 68.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.717 0.294 . . . . 73.019999999999996 110.872 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 mm -133.7 144.21 36.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 74.209999999999994 111.138 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.454 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -101.23 177.03 5.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.472 . . . . 73.409999999999997 111.176 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.454 ' H ' HG22 ' A' ' 88' ' ' THR . 0.0 OUTLIER -63.76 -43.57 96.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 74.010000000000005 110.84 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.44 -32.52 72.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 74.140000000000001 110.897 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -75.61 -43.16 49.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.128 -0.487 . . . . 71.409999999999997 110.934 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.83 -33.57 64.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 63.420000000000002 111.129 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -63.34 -53.29 54.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 61.32 110.883 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.08 -34.92 79.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 73.439999999999998 110.849 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 13.5 mt -60.56 -35.78 76.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 73.540000000000006 110.974 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.674 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -102.32 43.55 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 64.400000000000006 110.861 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.24 -60.04 5.48 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.673 0.749 . . . . 73.129999999999995 110.917 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.82 123.17 9.82 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.727 2.284 . . . . 74.5 112.345 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 117.82 5.31 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.63 2.22 . . . . 74.25 112.396 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -154.81 104.79 2.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 71.409999999999997 110.916 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.641 ' O ' HD12 ' A' ' 168' ' ' ILE . 33.2 p -57.98 111.92 1.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 33.32 111.165 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.05 -7.2 6.07 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.772 -0.728 . . . . 41.439999999999998 112.522 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.02 113.61 25.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.886 0.375 . . . . 63.219999999999999 110.899 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 27.0 p90 -125.22 165.2 18.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 75.099999999999994 110.853 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.621 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -161.54 137.28 7.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 64.129999999999995 110.939 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 89.0 t -110.19 142.88 21.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 74.120000000000005 111.132 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.96 148.83 25.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 73.349999999999994 110.855 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -52.08 124.21 12.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 73.349999999999994 110.916 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.2 m -59.81 117.31 4.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 55.109999999999999 110.928 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.59 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.3 m -69.12 -56.42 7.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.482 . . . . 50.219999999999999 111.146 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.456 ' H ' ' ND2' ' A' ' 111' ' ' ASN . 0.9 OUTLIER -70.96 -24.0 62.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 75.010000000000005 110.899 179.991 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -113.28 93.51 26.72 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.727 0.775 . . . . 74.319999999999993 110.94 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 111.07 2.7 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.721 2.28 . . . . 71.329999999999998 112.38 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.6 0.14 24.7 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.768 -0.73 . . . . 24.129999999999999 112.53 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -125.29 -175.88 3.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.797 0.332 . . . . 73.219999999999999 110.867 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -137.38 148.0 45.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 70.510000000000005 110.916 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 25.4 m -115.51 141.68 47.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.108 -0.496 . . . . 73.409999999999997 111.156 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.412 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.4 OUTLIER -111.79 116.56 30.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 73.200000000000003 110.911 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.1 t -100.65 129.16 46.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 74.230000000000004 110.911 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.412 ' CG2' HD21 ' A' ' 118' ' ' LEU . 17.3 t -130.03 149.11 33.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 73.310000000000002 111.066 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.674 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -101.07 111.03 23.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 61.030000000000001 110.852 -179.784 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.47 93.5 4.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 74.219999999999999 110.901 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 66.14 30.78 9.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 73.420000000000002 110.839 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.6 -14.3 63.29 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.73 -0.748 . . . . 74.219999999999999 112.536 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -88.08 147.5 24.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.756 0.312 . . . . 72.219999999999999 110.926 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.425 ' O ' HG23 ' A' ' 126' ' ' VAL . 7.0 m -105.51 109.22 27.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 62.43 111.14 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -96.94 113.7 25.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 72.329999999999998 110.865 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -91.13 124.65 35.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 74.239999999999995 110.815 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.638 ' CZ ' HD13 ' A' ' 163' ' ' LEU . 48.5 m-85 -114.08 116.19 28.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.218 -0.446 . . . . 72.310000000000002 110.909 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.48 137.07 46.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.102 -0.499 . . . . 70.450000000000003 110.872 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 26.0 mt -119.7 109.62 26.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 74.140000000000001 111.113 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -81.3 124.72 29.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.272 -0.422 . . . . 64.329999999999998 110.902 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.494 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -111.67 98.29 7.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.307 -0.406 . . . . 72.530000000000001 110.937 -179.875 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -132.06 142.57 49.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 72.400000000000006 110.897 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.18 35.97 26.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 74.439999999999998 111.073 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.38 26.6 16.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 71.400000000000006 110.84 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -131.93 139.14 48.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 72.040000000000006 110.894 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.494 HD21 ' CE2' ' A' ' 133' ' ' TYR . 3.7 mp -102.42 149.86 23.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 73.299999999999997 110.922 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 29.2 t -166.19 140.96 4.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 61.119999999999997 110.814 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.508 HG22 HG13 ' B' ' 317' ' ' VAL . 52.2 mt -115.59 -32.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.048 -0.524 . . . . 74.239999999999995 111.173 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.526 ' HA ' HG21 ' B' ' 317' ' ' VAL . 38.7 t0 -89.7 1.05 56.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 72.120000000000005 110.92 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 60.41 18.18 7.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 71.0 110.795 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -132.29 -38.43 1.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 72.209999999999994 110.88 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.4 t -103.06 104.54 16.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 44.340000000000003 111.132 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -99.88 144.69 28.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 62.009999999999998 110.933 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.531 ' CD1' HD12 ' A' ' 152' ' ' LEU . 54.8 m-85 -118.64 178.42 4.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 74.140000000000001 110.924 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -100.19 -16.22 17.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 75.230000000000004 110.917 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -164.81 171.65 13.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.111 -0.495 . . . . 71.230000000000004 110.874 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.459 HD12 ' H ' ' A' ' 149' ' ' LEU . 0.7 OUTLIER -74.63 -22.37 58.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 64.209999999999994 110.949 179.966 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.2 ttp -63.67 -56.96 11.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 73.430000000000007 110.876 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.82 -36.3 83.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.289 -0.414 . . . . 74.319999999999993 110.885 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.531 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.68 -47.58 76.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.198 -0.455 . . . . 73.530000000000001 110.916 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.478 HG13 HD12 ' A' ' 167' ' ' LEU . 70.7 t -65.29 -37.49 80.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 73.129999999999995 111.14 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -55.53 -38.76 69.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.134 -0.485 . . . . 64.409999999999997 110.926 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -45.29 61.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 75.430000000000007 110.891 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.415 ' CD1' HD23 ' A' ' 163' ' ' LEU . 27.9 m-85 -67.5 -22.17 65.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 74.140000000000001 110.962 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 63.6 m -84.32 -29.62 26.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.105 -0.498 . . . . 43.009999999999998 111.088 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 92.6 m -78.13 -26.94 48.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 75.209999999999994 111.15 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.09 160.8 30.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 62.240000000000002 110.85 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.81 -58.28 6.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 63.329999999999998 111.068 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 6.0 t0 57.12 23.58 8.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 73.129999999999995 110.947 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.29 -0.64 25.2 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.721 -0.752 . . . . 32.420000000000002 112.498 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.638 HD13 ' CZ ' ' A' ' 129' ' ' TYR . 4.0 mm? -93.28 140.08 29.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.942 0.401 . . . . 60.439999999999998 110.855 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 44.3 t -51.33 -30.37 18.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 52.420000000000002 110.871 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.8 t -158.96 127.34 5.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 70.329999999999998 111.137 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -51.35 140.59 16.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 71.400000000000006 110.868 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.478 HD12 HG13 ' A' ' 153' ' ' VAL . 8.6 mt -62.39 139.51 58.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 54.130000000000003 110.919 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.641 HD12 ' O ' ' A' ' 101' ' ' THR . 26.6 mt -126.94 -51.3 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.284 -0.416 . . . . 71.209999999999994 111.164 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -131.03 123.35 19.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.585 0.707 . . . . 73.109999999999999 110.951 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 135.43 30.44 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.711 2.274 . . . . 61.530000000000001 112.331 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.8 83.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.434 . . . . 75.219999999999999 110.886 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.7 m -64.32 136.8 25.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.296 -0.411 . . . . 72.120000000000005 111.165 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 70.109999999999999 110.824 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 CA-C-O 121.432 0.462 . . . . 72.030000000000001 112.451 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 168.41 21.56 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.666 2.244 . . . . 63.43 112.365 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 4.6 tp -52.27 -43.26 64.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 73.030000000000001 110.917 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 111.21 -40.01 2.7 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.674 -0.775 . . . . 55.240000000000002 112.469 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 2.1 t -70.53 96.36 1.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.907 0.384 . . . . 71.120000000000005 110.87 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 5.2 mttm -143.09 155.25 44.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 70.120000000000005 110.878 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.9 92.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 64.219999999999999 110.851 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 5.2 t80 179.18 108.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 75.420000000000002 110.934 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 31.5 t -79.94 109.88 14.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 74.239999999999995 110.816 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 80.0 p -77.9 -178.22 5.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.474 . . . . 75.340000000000003 110.821 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 1.7 mt -160.81 98.46 1.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.089 -0.505 . . . . 61.409999999999997 110.868 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 40.0 t -84.83 88.68 7.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 72.5 110.832 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -76.08 149.61 37.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 74.349999999999994 110.972 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.57 129.17 17.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.117 -0.492 . . . . 55.240000000000002 110.932 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 298' ' ' SER . . . . . 0.59 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -94.13 163.05 13.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.286 -0.416 . . . . 63.219999999999999 110.862 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 10.6 mtt180 -63.8 -15.42 58.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 72.310000000000002 110.853 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -37.94 84.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 72.420000000000002 110.876 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -96.98 -14.96 21.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.107 -0.497 . . . . 65.329999999999998 110.794 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.544 ' HB2' HD11 ' B' ' 305' ' ' LEU . 14.9 m-20 -156.39 80.75 3.7 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.577 0.703 . . . . 75.140000000000001 110.85 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -6.01 17.6 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.693 2.262 . . . . 65.040000000000006 112.341 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.2 t -93.61 27.26 2.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 72.230000000000004 111.188 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' B' ' 302' ' ' ASP . 34.7 mt -103.9 136.89 42.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 72.239999999999995 110.875 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.579 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.1 t -102.16 170.05 8.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.164 -0.471 . . . . 72.400000000000006 111.139 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -49.67 -33.89 16.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 64.219999999999999 110.919 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -62.5 -48.44 79.54 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.162 -0.472 . . . . 62.329999999999998 110.9 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.579 ' HG2' HG22 ' B' ' 306' ' ' THR . 7.9 mm-40 -65.14 -51.72 59.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 72.219999999999999 110.92 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 27.4 mm -58.59 -53.77 42.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 75.150000000000006 111.089 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 26.8 t -58.01 -24.3 57.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 75.239999999999995 110.84 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -74.55 -5.67 44.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 51.25 111.069 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.68 14.02 19.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.256 -0.429 . . . . 72.200000000000003 110.879 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 3.9 t -102.96 -36.13 8.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.115 -1.402 . . . . 62.149999999999999 110.795 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.88 152.82 0.05 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 50.32 110.915 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.526 HG21 ' HA ' ' A' ' 141' ' ' ASP . 4.5 m -54.19 122.28 3.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.468 . . . . 71.129999999999995 111.096 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -132.95 74.88 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.069 -0.514 . . . . 74.099999999999994 110.919 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.93 160.32 2.29 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.603 0.716 . . . . 61.130000000000003 110.932 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 112.28 3.03 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.674 2.249 . . . . 62.420000000000002 112.31 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.26 0 CA-C-O 119.169 -0.795 . . . . 44.140000000000001 112.471 179.959 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 CA-C-O 121.429 0.461 . . . . 75.010000000000005 112.554 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -46.87 1.06 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.653 2.235 . . . . 75.109999999999999 112.334 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.11 -43.56 14.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 72.430000000000007 110.908 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.61 24.46 5.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.702 -0.761 . . . . 32.299999999999997 112.479 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -157.49 27.65 0.29 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.886 0.374 . . . . 52.549999999999997 110.862 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -168.65 72.68 0.8 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.593 0.711 . . . . 73.409999999999997 110.942 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -27.78 26.18 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.675 2.25 . . . . 71.319999999999993 112.293 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.473 ' CH2' HG21 ' A' ' 153' ' ' VAL . 47.0 p-90 -54.82 -26.63 36.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 75.239999999999995 110.925 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -84.31 102.33 12.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 54.140000000000001 110.876 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 -76.39 -40.05 51.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 72.5 110.897 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.3 18.89 37.6 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.744 -0.741 . . . . 64.120000000000005 112.472 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -179.96 78.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.737 0.303 . . . . 74.310000000000002 110.864 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.5 mm -142.72 144.41 24.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 63.43 111.061 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.46 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -101.32 175.08 5.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.113 -0.494 . . . . 73.5 111.177 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.46 ' H ' HG22 ' A' ' 88' ' ' THR . 6.6 ttt180 -62.19 -42.71 99.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 75.150000000000006 110.883 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -68.34 -33.87 75.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.162 -0.472 . . . . 72.239999999999995 110.939 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -75.49 -41.78 54.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 74.319999999999993 110.922 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.48 -33.48 62.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.482 . . . . 55.119999999999997 111.129 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.448 ' OE2' HG21 ' A' ' 126' ' ' VAL . 20.3 mm-40 -63.4 -53.27 54.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.45 . . . . 75.329999999999998 110.922 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.18 -35.6 81.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.479 . . . . 74.129999999999995 110.832 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 16.7 mt -61.21 -35.82 78.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 55.409999999999997 110.892 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.669 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.5 mm? -102.96 43.12 1.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.19 -0.459 . . . . 63.329999999999998 110.878 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.495 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.18 -59.97 4.63 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.678 0.751 . . . . 72.040000000000006 110.907 179.996 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.9 Cg_endo -69.74 123.09 9.77 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.719 2.279 . . . . 65.400000000000006 112.323 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 118.21 5.54 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.665 2.243 . . . . 63.229999999999997 112.334 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -154.81 100.48 2.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.27 -0.423 . . . . 71.230000000000004 110.858 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.665 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.6 OUTLIER -53.46 111.76 0.77 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 74.25 111.146 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.81 -6.28 6.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.79 -0.719 . . . . 63.340000000000003 112.504 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.28 111.75 23.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.808 0.337 . . . . 73.120000000000005 110.916 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -124.54 162.06 24.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 73.310000000000002 110.89 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.578 HD23 HD21 ' A' ' 96' ' ' LEU . 0.7 OUTLIER -158.37 138.67 12.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 44.340000000000003 110.873 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.838 HG22 HD22 ' A' ' 118' ' ' LEU . 79.9 t -110.16 137.73 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 64.219999999999999 111.145 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -149.8 143.39 25.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.212 -0.449 . . . . 75.540000000000006 110.882 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -50.24 123.78 9.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.447 . . . . 75.530000000000001 110.823 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 m -57.56 115.79 2.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.456 . . . . 72.230000000000004 110.86 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.617 HG21 ' HB2' ' B' ' 298' ' ' SER . 2.2 m -68.57 -56.39 8.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 61.340000000000003 111.133 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.619 ' CG ' HD12 ' B' ' 310' ' ' ILE . 4.3 m-80 -69.28 -26.62 64.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 71.430000000000007 110.921 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.407 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 2.7 m-85 -112.28 94.46 26.62 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.632 0.729 . . . . 70.140000000000001 110.939 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.5 Cg_endo -69.77 112.26 3.03 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.663 2.242 . . . . 55.450000000000003 112.384 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.77 3.29 23.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.743 -0.741 . . . . 74.219999999999999 112.434 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -131.05 -176.06 3.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.816 0.341 . . . . 65.010000000000005 110.907 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -131.67 165.58 23.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 74.310000000000002 110.929 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.607 HG23 ' HE2' ' B' ' 314' ' ' PTR . 99.1 m -126.56 141.61 51.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.086 -0.506 . . . . 72.310000000000002 111.184 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.838 HD22 HG22 ' A' ' 106' ' ' VAL . 0.0 OUTLIER -109.16 106.32 16.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.279 -0.418 . . . . 75.329999999999998 110.885 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.6 m -98.99 118.69 36.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.47 . . . . 60.450000000000003 110.911 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.4 t -124.36 150.41 29.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 72.230000000000004 111.045 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.669 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -103.95 112.36 25.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 71.450000000000003 110.941 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.6 97.58 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.07 -0.514 . . . . 72.329999999999998 110.849 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 65.74 27.61 11.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 74.230000000000004 110.884 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.75 -13.38 63.92 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.752 -0.737 . . . . 72.230000000000004 112.498 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -88.38 140.3 29.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.764 0.316 . . . . 70.450000000000003 110.936 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.59 ' O ' HD13 ' B' ' 294' ' ' LEU . 11.2 m -100.47 111.37 29.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 70.200000000000003 111.13 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.454 ' OE2' HD11 ' B' ' 294' ' ' LEU . 2.7 mm-40 -99.68 124.84 45.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 75.230000000000004 110.89 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 61.1 m-70 -103.39 124.0 47.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 61.450000000000003 110.873 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.523 ' HB3' HD13 ' A' ' 140' ' ' ILE . 88.5 m-85 -114.67 100.24 8.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 72.319999999999993 110.964 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -55.54 131.76 46.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 74.340000000000003 110.834 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.819 HD11 HD23 ' A' ' 118' ' ' LEU . 38.2 mt -110.45 109.63 29.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 72.230000000000004 111.133 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.76 129.08 34.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.109999999999999 110.924 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.46 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.97 100.71 8.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.271 -0.422 . . . . 63.119999999999997 110.974 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -134.68 142.43 46.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 74.430000000000007 110.913 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 57.38 36.13 26.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 63.409999999999997 111.058 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.7 t 61.04 27.46 17.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 64.299999999999997 110.858 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 2.7 mtmm -133.21 145.34 50.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.136 -0.484 . . . . 75.409999999999997 110.82 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.46 HD21 ' CE2' ' A' ' 133' ' ' TYR . 1.6 mp -106.22 150.8 25.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 71.019999999999996 110.909 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.9 t -169.62 140.8 2.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 74.120000000000005 110.862 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.526 HD11 HG12 ' A' ' 131' ' ' ILE . 59.7 mt -115.51 -26.19 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 61.130000000000003 111.175 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.689 ' HB3' HG21 ' B' ' 317' ' ' VAL . 5.9 p30 -96.67 -2.48 44.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 53.520000000000003 110.884 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 61.94 16.75 8.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 63.020000000000003 110.882 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -127.36 -34.07 2.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 72.329999999999998 110.894 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.4 t -111.86 104.75 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 64.010000000000005 111.127 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -98.33 143.44 28.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.47 . . . . 75.329999999999998 110.931 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.44 ' CD1' HD12 ' A' ' 152' ' ' LEU . 48.4 m-85 -117.51 171.53 7.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.083 -0.508 . . . . 74.109999999999999 110.862 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.68 -18.95 24.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.193 -0.458 . . . . 75.530000000000001 110.861 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.508 ' OD1' HD12 ' A' ' 149' ' ' LEU . 45.6 t30 -171.24 158.84 5.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 75.200000000000003 110.905 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.508 HD12 ' OD1' ' A' ' 148' ' ' ASN . 2.4 mp -51.36 -36.88 45.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 72.140000000000001 110.961 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.4 ttp -51.87 -48.87 63.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 74.5 110.939 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.99 -41.67 77.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 71.450000000000003 110.943 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.44 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.5 OUTLIER -56.0 -50.55 70.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 51.399999999999999 110.906 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.473 HG21 ' CH2' ' A' ' 82' ' ' TRP . 91.4 t -59.02 -43.67 89.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 72.310000000000002 111.141 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.78 -39.51 71.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 72.319999999999993 110.896 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.75 -50.74 48.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 71.340000000000003 110.842 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.424 ' CD1' HD13 ' A' ' 163' ' ' LEU . 38.2 m-85 -65.46 -19.63 66.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.469 . . . . 74.200000000000003 110.934 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.475 ' OG1' HD12 ' A' ' 167' ' ' LEU . 97.3 m -84.24 -28.77 27.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.13 -0.486 . . . . 74.310000000000002 111.041 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 27.2 m -81.92 -24.4 35.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.331 -0.395 . . . . 71.329999999999998 111.148 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -161.7 162.25 29.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 64.150000000000006 110.874 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.46 -58.1 7.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.207 -0.451 . . . . 64.150000000000006 111.0 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.76 20.5 10.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 75.420000000000002 110.911 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 112.3 13.53 11.83 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 14.5 112.483 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.424 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.6 mp -108.75 138.41 45.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.85 0.357 . . . . 75.230000000000004 110.936 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 31.6 t -51.66 -31.17 24.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 74.109999999999999 110.901 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 7.2 t -153.99 124.17 6.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.141 -0.481 . . . . 62.009999999999998 111.15 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -51.88 156.08 1.59 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 65.200000000000003 110.845 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.475 HD12 ' OG1' ' A' ' 157' ' ' THR . 7.7 mt -72.51 134.93 45.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 72.030000000000001 110.947 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.665 HD12 ' O ' ' A' ' 101' ' ' THR . 24.6 mt -127.03 -51.11 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.191 -0.459 . . . . 73.120000000000005 111.179 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -127.55 121.13 22.18 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.534 0.683 . . . . 74.099999999999994 110.866 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 135.13 29.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.694 2.263 . . . . 65.400000000000006 112.349 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.66 84.04 0.44 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 73.109999999999999 110.914 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 22.0 t -64.42 131.42 30.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 72.310000000000002 111.099 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 33.3 mtp . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 75.430000000000007 110.881 179.91 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 CA-C-O 121.411 0.451 . . . . 32.409999999999997 112.493 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 168.12 22.49 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.631 2.221 . . . . 74.439999999999998 112.331 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 11.5 tp -63.86 -27.9 69.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.254 -0.43 . . . . 72.540000000000006 110.953 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 99.7 27.41 7.99 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.702 -0.761 . . . . 62.299999999999997 112.522 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 80.5 p -102.97 164.36 11.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.91 0.386 . . . . 52.32 110.873 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.67 109.74 3.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.15 -0.477 . . . . 73.230000000000004 110.933 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -156.15 149.75 24.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.219999999999999 110.901 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -169.62 83.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 74.329999999999998 110.958 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 1.1 m -176.59 99.88 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 55.100000000000001 110.85 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 1.5 m -139.54 90.3 2.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.086 -0.506 . . . . 61.229999999999997 110.859 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.59 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER -163.81 104.63 0.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 74.219999999999999 110.888 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 2.2 m -113.59 89.03 2.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 64.209999999999994 110.866 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -72.32 148.26 45.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.51 . . . . 75.230000000000004 110.896 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -143.12 129.08 19.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.089 -0.505 . . . . 74.530000000000001 110.879 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 298' ' ' SER . . . . . 0.617 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -92.04 158.77 16.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.232 -0.44 . . . . 72.140000000000001 110.781 -179.862 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -59.76 -19.01 47.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 73.430000000000007 110.817 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -37.2 86.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 71.400000000000006 110.887 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -96.59 -17.6 20.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 74.439999999999998 110.872 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -155.05 79.92 4.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.583 0.706 . . . . 71.219999999999999 110.843 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -5.69 16.79 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.654 2.236 . . . . 62.100000000000001 112.353 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.4 t -92.68 27.53 2.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 73.420000000000002 111.132 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 23.8 mt -102.01 136.79 41.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.424 . . . . 72.329999999999998 110.922 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.642 HG22 ' HG2' ' B' ' 309' ' ' GLU . 12.1 t -105.98 174.84 5.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 74.400000000000006 111.151 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -49.6 -37.97 29.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 72.420000000000002 110.868 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.61 -51.83 66.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.149 -0.478 . . . . 74.230000000000004 110.846 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.642 ' HG2' HG22 ' B' ' 306' ' ' THR . 20.5 mm-40 -63.43 -52.08 63.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 74.049999999999997 110.909 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.619 HD12 ' CG ' ' A' ' 111' ' ' ASN . 43.1 mm -56.83 -53.78 37.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 72.120000000000005 111.1 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 26.3 t -58.85 -22.44 58.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.441 . . . . 63.240000000000002 110.868 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.53 4.13 25.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 74.340000000000003 111.065 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -109.51 14.3 23.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.236 -0.438 . . . . 74.420000000000002 110.863 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.607 ' HE2' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 1.6 t -98.71 -27.6 13.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 114.071 -1.422 . . . . 72.450000000000003 110.903 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 64.74 153.66 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.049 -0.523 . . . . 70.230000000000004 110.822 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.689 HG21 ' HB3' ' A' ' 141' ' ' ASP . 4.6 m -52.56 126.34 8.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.097 -0.501 . . . . 54.130000000000003 111.135 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -136.61 77.47 1.65 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 75.420000000000002 110.939 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -52.8 160.58 1.4 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.511 0.672 . . . . 73.120000000000005 110.95 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 113.52 3.4 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.678 2.252 . . . . 74.439999999999998 112.307 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 CA-C-O 119.146 -0.808 . . . . 71.430000000000007 112.556 179.948 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 CA-C-O 121.322 0.401 . . . . 74.25 112.468 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 -171.79 0.51 Allowed 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.603 2.202 . . . . 73.420000000000002 112.381 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.6 mp -54.64 -30.25 54.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 70.510000000000005 110.894 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 106.17 20.45 9.21 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.738 -0.744 . . . . 63.119999999999997 112.445 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 32.2 t -170.28 58.42 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.866 0.365 . . . . 63.340000000000003 110.905 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.0 mtt -139.96 74.07 32.11 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.498 0.666 . . . . 64.5 110.843 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 -7.55 21.34 Favored 'Trans proline' 0 N--CA 1.466 -0.113 0 C-N-CA 122.665 2.243 . . . . 62.32 112.402 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.469 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 35.1 p-90 -101.25 -29.41 12.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 74.329999999999998 110.897 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -90.3 106.58 18.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.278 -0.419 . . . . 72.510000000000005 110.939 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -83.63 -41.81 17.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 75.439999999999998 110.839 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 52.14 34.48 39.77 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.703 -0.761 . . . . 55.109999999999999 112.477 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.17 34.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.776 0.322 . . . . 64.200000000000003 110.864 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.7 mm -102.69 144.2 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 55.219999999999999 111.153 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.06 157.43 17.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 75.099999999999994 111.108 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.3 ppt_? -52.94 -36.95 60.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 74.409999999999997 110.896 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.2 -32.08 55.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 75.219999999999999 110.886 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -72.88 -35.23 67.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 74.129999999999995 110.929 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.99 -34.78 59.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 70.239999999999995 111.092 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -63.3 -52.69 60.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 72.239999999999995 110.863 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -39.51 94.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 71.430000000000007 110.811 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.3 mt -54.99 -39.34 68.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.276 -0.42 . . . . 73.409999999999997 110.943 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.639 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -99.01 43.38 1.06 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 74.019999999999996 110.904 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.494 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.42 -59.92 5.43 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.711 0.767 . . . . 71.219999999999999 110.926 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.69 123.41 10.1 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.719 2.279 . . . . 75.109999999999999 112.418 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 117.53 5.13 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.659 2.239 . . . . 64.25 112.379 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -154.75 112.34 3.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.455 . . . . 70.430000000000007 110.965 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.667 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.7 OUTLIER -63.92 111.73 2.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.466 . . . . 70.120000000000005 111.209 -179.9 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.95 -6.2 6.1 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.713 -0.756 . . . . 42.439999999999998 112.463 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.405 HD12 ' O ' ' A' ' 169' ' ' LYS . 2.4 tp -90.94 113.99 26.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.824 0.345 . . . . 72.099999999999994 110.922 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.444 ' HB3' HD22 ' A' ' 167' ' ' LEU . 18.9 p90 -125.55 166.09 17.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.141 -0.481 . . . . 62.340000000000003 110.863 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.556 HD23 HD21 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -163.93 138.33 5.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.151 -0.477 . . . . 64.420000000000002 110.907 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.469 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 90.5 t -110.37 128.22 66.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 42.119999999999997 111.141 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 145.13 42.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 71.230000000000004 110.821 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.62 127.15 19.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 63.130000000000003 110.864 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.8 m -61.82 113.34 2.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 52.329999999999998 110.87 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.543 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.8 m -69.31 -55.99 8.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.487 . . . . 52.420000000000002 111.083 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.63 ' CG ' HD12 ' B' ' 310' ' ' ILE . 42.4 m-80 -63.57 -28.97 70.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 73.219999999999999 110.888 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.427 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 33.8 m-85 -119.76 96.94 49.76 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.757 0.789 . . . . 64.420000000000002 110.94 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.7 Cg_endo -69.77 119.15 6.15 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.672 2.248 . . . . 62.520000000000003 112.375 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.73 -12.82 22.76 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.727 . . . . 71.319999999999993 112.499 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -114.26 -178.55 3.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.807 0.337 . . . . 75.030000000000001 110.85 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -131.05 160.21 35.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 62.32 110.964 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 58.8 m -133.36 131.85 40.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 73.549999999999997 111.12 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.445 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.3 OUTLIER -100.98 121.39 41.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 63.539999999999999 110.836 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.3 m -105.36 126.18 51.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.109 -0.496 . . . . 72.0 110.918 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.445 ' CG2' HD21 ' A' ' 118' ' ' LEU . 16.1 t -126.0 151.89 32.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.174 -0.466 . . . . 74.430000000000007 111.079 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.639 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.47 111.72 24.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 73.340000000000003 110.874 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.7 93.27 4.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.143 -0.481 . . . . 63.25 110.839 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 66.19 29.72 9.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 71.319999999999993 110.962 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.99 -13.42 63.54 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.715 -0.755 . . . . 40.200000000000003 112.525 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.2 ptpt -88.3 139.25 30.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.33 . . . . 72.420000000000002 110.884 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.602 ' O ' HD13 ' B' ' 294' ' ' LEU . 94.0 t -99.66 104.69 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 71.040000000000006 111.169 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -92.81 122.06 34.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 54.509999999999998 110.918 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -100.84 124.85 47.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.13 -0.486 . . . . 72.409999999999997 110.85 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -111.9 118.69 36.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.22 -0.445 . . . . 63.509999999999998 110.937 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -68.16 134.99 51.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 72.200000000000003 110.87 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.47 ' CG2' HD23 ' A' ' 138' ' ' LEU . 53.2 mt -117.59 109.59 28.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.476 . . . . 74.019999999999996 111.15 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.8 129.18 34.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 73.120000000000005 110.894 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.461 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.64 98.99 7.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 72.209999999999994 110.89 -179.822 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -130.94 142.44 50.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 73.340000000000003 110.908 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.12 36.77 27.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 72.239999999999995 111.07 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.26 23.95 14.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 73.109999999999999 110.817 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 3.8 mtmt -128.93 140.48 51.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.164 -0.471 . . . . 72.530000000000001 110.947 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.47 HD23 ' CG2' ' A' ' 131' ' ' ILE . 2.8 mp -101.73 151.93 21.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 72.319999999999993 110.945 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 39.6 t -168.43 142.22 3.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 74.420000000000002 110.874 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.443 HG22 HG13 ' B' ' 317' ' ' VAL . 52.6 mt -115.54 -40.83 3.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 72.319999999999993 111.125 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.703 ' HB3' HG21 ' B' ' 317' ' ' VAL . 38.1 p-10 -88.0 -1.04 57.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 61.020000000000003 110.93 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 59.6 20.04 8.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 65.430000000000007 110.877 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -123.23 -35.61 2.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 65.120000000000005 110.779 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.454 HG12 ' OD2' ' A' ' 141' ' ' ASP . 2.6 p -119.11 105.02 16.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 71.439999999999998 111.056 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -92.92 153.93 18.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 75.450000000000003 110.896 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -124.3 174.23 7.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 73.140000000000001 110.936 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.76 -17.91 21.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.010000000000005 110.849 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -171.82 158.85 5.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.478 . . . . 63.020000000000003 110.899 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.86 -36.02 46.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 64.430000000000007 110.9 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 2.6 ttt -53.03 -49.55 66.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 73.340000000000003 110.946 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.84 -39.69 83.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 71.230000000000004 110.948 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.9 -51.63 66.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 70.230000000000004 110.928 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.569 HG13 HD12 ' A' ' 167' ' ' LEU . 98.8 t -59.72 -42.85 90.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.230000000000004 111.078 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -54.39 -37.77 65.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 63.310000000000002 110.831 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -50.42 28.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 63.240000000000002 110.813 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.559 ' CD1' HD13 ' A' ' 163' ' ' LEU . 48.6 m-85 -66.49 -14.6 62.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 75.319999999999993 110.895 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 81.7 m -88.73 -32.35 17.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 70.230000000000004 111.119 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.9 m -80.27 -22.55 41.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 62.130000000000003 111.19 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -161.89 161.96 29.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 73.430000000000007 110.892 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.94 -58.07 6.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 73.120000000000005 111.124 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.87 18.45 10.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.468 . . . . 74.209999999999994 110.836 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.57 3.59 27.05 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.701 -0.761 . . . . 44.549999999999997 112.484 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.559 HD13 ' CD1' ' A' ' 156' ' ' TYR . 7.2 mp -95.61 138.63 33.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.85 0.357 . . . . 71.200000000000003 110.986 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 41.0 t -51.52 -29.87 18.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 73.530000000000001 110.948 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.7 t -156.17 122.76 5.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 74.400000000000006 111.101 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -51.28 147.36 5.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 63.240000000000002 110.898 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.569 HD12 HG13 ' A' ' 153' ' ' VAL . 6.8 mt -65.78 133.86 51.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 73.519999999999996 110.987 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.667 HD12 ' O ' ' A' ' 101' ' ' THR . 28.1 mt -127.12 -51.32 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 74.140000000000001 111.153 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 169' ' ' LYS . . . . . 0.405 ' O ' HD12 ' A' ' 103' ' ' LEU . 6.0 mtpm? -126.67 118.38 22.71 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.481 0.657 . . . . 75.230000000000004 110.961 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.68 139.95 41.79 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.689 2.26 . . . . 51.5 112.36 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 171' ' ' LYS . . . . . 0.404 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -70.07 82.94 0.51 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 73.310000000000002 110.912 179.876 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 15.8 m -64.81 125.99 22.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.278 -0.419 . . . . 71.319999999999993 111.171 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 30.3 mtp . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 72.540000000000006 110.847 179.969 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 CA-C-O 121.45 0.472 . . . . 71.319999999999993 112.475 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 164.47 34.44 Favored 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.729 2.286 . . . . 73.439999999999998 112.304 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 7.2 mp -54.99 -39.19 68.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.193 -0.458 . . . . 61.130000000000003 110.931 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 109.89 19.91 7.91 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.706 -0.759 . . . . 54.420000000000002 112.432 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.68 152.37 17.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.901 0.381 . . . . 75.209999999999994 110.829 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.46 136.93 10.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.129 -0.487 . . . . 75.239999999999995 110.896 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.4 93.05 0.27 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 61.200000000000003 110.83 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -172.55 105.34 0.16 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.22 -0.446 . . . . 71.439999999999998 110.92 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 47.6 t -109.47 113.68 26.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 70.25 110.781 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 56.8 p -59.72 -174.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.535 . . . . 53.420000000000002 110.824 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.602 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.3 OUTLIER -163.96 113.3 1.23 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.099 -0.5 . . . . 75.299999999999997 110.868 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 12.2 t -119.99 88.33 2.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 75.349999999999994 110.912 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -75.09 149.25 39.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 64.049999999999997 110.881 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.98 129.14 19.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.097 -0.501 . . . . 65.310000000000002 110.911 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 298' ' ' SER . . . . . 0.543 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -91.42 163.62 14.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 63.119999999999997 110.851 -179.844 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -64.06 -14.98 58.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.074 -0.512 . . . . 74.0 110.86 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -37.34 79.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 53.119999999999997 110.86 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -98.11 -18.21 18.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.103 -0.499 . . . . 74.099999999999994 110.893 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.432 ' HB2' HD11 ' B' ' 305' ' ' LEU . 8.0 m-20 -151.47 78.06 7.1 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.65 0.738 . . . . 75.239999999999995 110.923 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -5.95 17.39 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.681 2.254 . . . . 73.319999999999993 112.382 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.6 t -93.32 27.5 2.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 74.140000000000001 111.113 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' B' ' 302' ' ' ASP . 31.3 mt -101.45 136.82 40.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 54.100000000000001 110.894 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.645 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -106.03 173.55 6.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 55.130000000000003 111.09 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -49.4 -37.77 26.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 71.109999999999999 110.873 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -60.91 -53.02 62.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 53.229999999999997 110.912 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.645 ' HG2' HG22 ' B' ' 306' ' ' THR . 15.0 mm-40 -62.93 -52.44 63.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.195 -0.457 . . . . 74.540000000000006 110.91 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.63 HD12 ' CG ' ' A' ' 111' ' ' ASN . 41.9 mm -55.9 -53.92 32.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.11 -0.496 . . . . 75.400000000000006 111.154 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 60.5 p -58.71 -21.8 55.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 75.420000000000002 110.86 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.23 4.09 24.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 55.210000000000001 111.101 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 313' ' ' MET . . . . . 0.573 ' HE2' HD13 ' B' ' 310' ' ' ILE . 1.9 mtm -115.0 14.14 17.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.458 . . . . 53.439999999999998 110.935 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.584 ' HE1' HG22 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 11.6 t -109.46 -38.49 5.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.14 -1.391 . . . . 64.319999999999993 110.779 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.77 132.67 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.465 . . . . 60.409999999999997 110.806 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.703 HG21 ' HB3' ' A' ' 141' ' ' ASP . 20.7 m -52.47 125.64 6.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.042 -0.527 . . . . 71.430000000000007 111.13 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -130.59 76.34 1.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 75.310000000000002 110.841 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -57.85 160.62 7.92 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.601 0.715 . . . . 74.299999999999997 110.859 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 112.22 3.02 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.669 2.246 . . . . 75.099999999999994 112.342 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 CA-C-O 119.095 -0.836 . . . . 74.120000000000005 112.409 -179.962 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 CA-C-O 121.396 0.442 . . . . 73.140000000000001 112.462 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -19.9 35.59 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.664 2.243 . . . . 60.32 112.322 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.12 -22.91 8.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 74.219999999999999 110.909 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -51.99 -36.82 43.77 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.701 -0.761 . . . . 71.319999999999993 112.525 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -130.0 44.99 2.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.845 0.355 . . . . 75.420000000000002 110.781 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 28.3 mtt -151.76 74.22 7.88 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.623 0.725 . . . . 73.340000000000003 110.948 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -7.62 21.52 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.724 2.283 . . . . 73.049999999999997 112.347 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.476 ' CH2' HG21 ' A' ' 153' ' ' VAL . 42.9 p-90 -99.98 -29.81 12.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.221 -0.445 . . . . 74.420000000000002 110.832 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -85.78 99.3 11.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.261 -0.427 . . . . 65.230000000000004 110.895 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.7 m80 -75.88 -37.0 59.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 62.420000000000002 110.796 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.61 19.61 35.52 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.722 -0.752 . . . . 43.520000000000003 112.509 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.65 80.51 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.7 0.286 . . . . 53.549999999999997 110.82 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.589 HG23 ' HB3' ' A' ' 91' ' ' GLN . 27.2 mm -145.12 144.99 21.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.277 -0.419 . . . . 61.409999999999997 111.175 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.3 p -100.38 177.09 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.214 -0.448 . . . . 64.299999999999997 111.216 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 64.1 ttt-85 -63.75 -41.22 98.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 62.149999999999999 110.858 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.36 -36.79 83.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.435 . . . . 74.450000000000003 110.914 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.589 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -75.25 -39.8 59.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 71.319999999999993 110.969 -179.938 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.46 -33.94 65.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 71.409999999999997 111.074 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -65.0 -53.34 47.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.445 . . . . 72.239999999999995 110.887 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -35.55 81.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.46 . . . . 74.230000000000004 110.891 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.55 -35.43 77.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 52.030000000000001 110.926 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.638 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -105.48 43.38 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.109999999999999 110.951 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.488 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.98 -60.21 4.56 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.748 0.785 . . . . 62.539999999999999 110.933 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.3 Cg_endo -69.79 123.64 10.29 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.663 2.242 . . . . 73.230000000000004 112.343 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.8 117.57 5.16 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.717 2.278 . . . . 71.239999999999995 112.392 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -154.72 110.3 3.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.191 -0.459 . . . . 74.209999999999994 110.889 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.664 ' O ' HD12 ' A' ' 168' ' ' ILE . 1.1 p -61.98 111.88 2.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 75.019999999999996 111.114 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.68 -6.88 6.2 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 73.129999999999995 112.491 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.439 HD21 ' HE3' ' A' ' 171' ' ' LYS . 2.7 tp -90.72 111.79 23.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.855 0.36 . . . . 74.099999999999994 110.859 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.418 ' HB3' HD22 ' A' ' 167' ' ' LEU . 18.9 p90 -123.12 167.63 13.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 73.420000000000002 110.879 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.576 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -163.39 137.13 5.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.114 -0.494 . . . . 73.209999999999994 110.883 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.44 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 90.1 t -110.4 135.16 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 74.349999999999994 111.143 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -149.1 140.51 23.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 53.350000000000001 110.888 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -50.96 124.01 10.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.437 . . . . 61.200000000000003 110.857 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.7 t -55.44 119.38 5.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 50.130000000000003 110.866 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 94.1 m -70.15 -56.15 7.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 71.120000000000005 111.111 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.458 HD22 ' P ' ' B' ' 314' ' ' PTR . 0.8 OUTLIER -63.42 -42.64 98.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.255 -0.43 . . . . 70.140000000000001 110.871 -179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -106.01 96.08 12.24 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.621 0.724 . . . . 74.420000000000002 110.923 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 122.21 8.88 Favored 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 122.647 2.232 . . . . 74.230000000000004 112.342 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.75 -9.64 23.57 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.757 -0.735 . . . . 74.230000000000004 112.479 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -118.64 176.89 5.05 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.768 0.318 . . . . 62.25 110.925 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -124.13 158.68 31.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.285 -0.416 . . . . 72.310000000000002 110.93 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.693 HG23 ' HE2' ' B' ' 314' ' ' PTR . 27.5 m -132.19 121.67 24.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 72.310000000000002 111.194 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.443 HD23 ' CD1' ' A' ' 129' ' ' TYR . 0.4 OUTLIER -95.01 116.84 29.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 73.239999999999995 110.916 179.974 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 1.8 t -102.33 125.53 49.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.278 -0.419 . . . . 53.039999999999999 110.811 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.1 t -125.68 151.39 31.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 63.119999999999997 111.141 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.638 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.06 112.07 24.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.476 . . . . 75.530000000000001 110.843 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.55 94.36 4.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 75.230000000000004 110.904 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 66.56 29.15 9.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.329999999999998 110.925 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 98.0 -14.3 62.79 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.7 -0.762 . . . . 72.120000000000005 112.523 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.88 139.65 30.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.806 0.336 . . . . 64.409999999999997 110.973 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.447 ' O ' HG23 ' A' ' 126' ' ' VAL . 6.2 m -98.84 99.68 9.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.289 -0.414 . . . . 73.530000000000001 111.157 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -86.67 123.75 32.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 73.239999999999995 110.915 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 53.6 m-70 -101.38 127.15 48.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.118 -0.492 . . . . 74.299999999999997 110.946 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.443 ' CD1' HD23 ' A' ' 118' ' ' LEU . 69.5 m-85 -113.48 106.23 14.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 71.430000000000007 110.933 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -58.26 137.25 57.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 72.129999999999995 110.902 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.448 ' CG2' HD23 ' A' ' 138' ' ' LEU . 61.8 mt -117.97 107.31 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 74.150000000000006 111.163 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.77 126.68 31.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 73.329999999999998 110.874 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -113.88 114.62 26.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.456 . . . . 74.430000000000007 110.936 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -149.72 138.37 20.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.137 -0.483 . . . . 72.239999999999995 110.922 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 53.66 35.83 22.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 64.409999999999997 111.094 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.72 28.81 16.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 63.530000000000001 110.863 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -129.36 140.1 51.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 71.409999999999997 110.847 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.448 HD23 ' CG2' ' A' ' 131' ' ' ILE . 1.8 mp -105.51 147.22 28.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 61.399999999999999 110.883 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 28.0 t -164.45 139.17 5.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 73.019999999999996 110.874 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.43 HG22 HG13 ' B' ' 317' ' ' VAL . 46.2 mt -115.53 -40.85 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.145 -0.48 . . . . 60.109999999999999 111.152 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.483 ' HA ' HG21 ' B' ' 317' ' ' VAL . 20.7 p30 -83.86 -7.02 59.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 71.140000000000001 110.882 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 61.79 16.12 7.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.187 -0.46 . . . . 73.400000000000006 110.889 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -123.23 -11.29 7.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 71.030000000000001 110.916 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -143.07 104.36 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.156 -0.474 . . . . 63.340000000000003 111.118 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -92.58 144.68 25.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.230000000000004 110.885 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -115.17 175.37 5.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.096 -0.502 . . . . 74.540000000000006 110.868 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.34 -13.92 18.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 45.210000000000001 110.932 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -168.7 171.84 8.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 65.109999999999999 110.883 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 mp -73.87 -24.02 59.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 70.319999999999993 110.908 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -59.6 -56.89 16.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 74.510000000000005 110.889 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -68.08 -36.5 79.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 61.32 110.885 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.47 -52.98 61.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.245 -0.434 . . . . 72.340000000000003 110.968 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.476 HG21 ' CH2' ' A' ' 82' ' ' TRP . 56.9 t -62.61 -36.22 74.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.116 -0.493 . . . . 73.329999999999998 111.133 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -55.33 -39.49 70.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 74.450000000000003 110.883 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -71.89 -50.3 30.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 74.25 110.838 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -62.71 -22.32 66.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 74.040000000000006 110.95 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.654 ' OG1' HD12 ' A' ' 167' ' ' LEU . 89.1 m -86.38 -27.13 24.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 72.129999999999995 111.166 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 90.0 m -79.4 -23.66 43.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 74.400000000000006 111.095 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.76 165.45 23.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.249 -0.432 . . . . 64.239999999999995 110.892 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.27 -58.3 6.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.46 . . . . 40.420000000000002 111.101 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 58.65 21.38 8.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.119 -0.491 . . . . 70.340000000000003 110.814 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 106.75 16.69 13.39 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.692 -0.766 . . . . 73.430000000000007 112.465 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.6 mp -107.3 140.31 40.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.833 0.349 . . . . 64.319999999999993 110.933 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 48.6 t -51.78 -29.89 20.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 73.200000000000003 110.912 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.7 t -159.4 123.58 3.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 75.540000000000006 111.176 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.96 146.16 6.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 62.219999999999999 110.884 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.654 HD12 ' OG1' ' A' ' 157' ' ' THR . 7.3 mt -65.0 136.68 57.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 75.219999999999999 110.903 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.664 HD12 ' O ' ' A' ' 101' ' ' THR . 28.1 mt -127.06 -51.23 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.273 -0.421 . . . . 72.239999999999995 111.167 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.21 119.63 19.73 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.659 0.742 . . . . 72.340000000000003 110.851 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 140.76 43.39 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.73 2.287 . . . . 71.230000000000004 112.361 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' LYS . . . . . 0.439 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -70.67 82.72 0.61 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 72.530000000000001 110.891 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 26.8 m -64.89 129.03 28.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.411 . . . . 64.200000000000003 111.079 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.9 ptm . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 64.510000000000005 110.853 179.912 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 CA-C-O 121.484 0.491 . . . . 75.239999999999995 112.53 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 129.45 17.69 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.707 2.271 . . . . 74.510000000000005 112.366 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 70.74 -70.63 0.15 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.325 -0.398 . . . . 75.129999999999995 110.895 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 92.87 19.65 36.27 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.754 -0.736 . . . . 64.430000000000007 112.494 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.76 142.52 32.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.945 0.403 . . . . 72.319999999999993 110.843 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -150.3 160.45 43.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.503 . . . . 72.120000000000005 110.907 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.02 146.67 10.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 72.319999999999993 110.888 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -148.14 85.42 1.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 71.200000000000003 110.88 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 6.0 p -179.36 70.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 72.409999999999997 110.841 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 49.2 m -115.22 79.44 1.28 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.107 -0.497 . . . . 64.239999999999995 110.843 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -143.23 117.83 9.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 72.209999999999994 110.911 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 9.4 t -123.03 88.07 2.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 74.209999999999994 110.795 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -76.19 149.06 37.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.107 -0.497 . . . . 73.549999999999997 110.937 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -158.2 129.73 6.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 70.420000000000002 110.884 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.13 175.83 5.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.245 -0.434 . . . . 44.32 110.873 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 26.5 mtt180 -64.48 -15.67 61.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 73.010000000000005 110.864 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -41.83 99.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 71.129999999999995 110.906 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -104.2 -10.38 17.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.099 -0.5 . . . . 52.149999999999999 110.937 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.529 ' HB2' HD11 ' B' ' 305' ' ' LEU . 7.1 m-20 -158.15 78.6 3.33 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.598 0.713 . . . . 75.510000000000005 110.872 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -6.12 17.81 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.697 2.264 . . . . 61.119999999999997 112.344 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.9 t -93.18 27.18 2.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.246 -0.434 . . . . 73.25 111.102 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.529 HD11 ' HB2' ' B' ' 302' ' ' ASP . 31.2 mt -105.1 137.97 42.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.436 . . . . 72.129999999999995 110.894 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.605 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -103.66 173.46 6.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 40.32 111.209 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -50.33 -32.83 18.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 73.420000000000002 110.918 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 308' ' ' GLU . . . . . 0.462 ' H ' HG23 ' B' ' 306' ' ' THR . 0.1 OUTLIER -65.83 -47.64 74.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 64.120000000000005 110.855 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.605 ' HG2' HG22 ' B' ' 306' ' ' THR . 20.5 mm-40 -67.42 -52.35 40.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 75.129999999999995 110.904 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 46.0 mm -55.94 -46.79 80.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 70.230000000000004 111.152 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 27.9 p -72.06 -17.03 62.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 74.329999999999998 110.855 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.39 2.42 32.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 61.43 111.17 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -115.12 14.21 16.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 61.43 110.902 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.693 ' HE2' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -97.95 -34.52 10.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.083 -1.417 . . . . 74.120000000000005 110.849 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 65.15 151.05 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 72.420000000000002 110.874 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.483 HG21 ' HA ' ' A' ' 141' ' ' ASP . 6.7 m -51.47 122.58 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 73.310000000000002 111.132 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -135.26 76.7 1.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 75.219999999999999 110.927 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -55.22 160.33 3.47 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.618 0.723 . . . . 73.209999999999994 110.877 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 113.1 3.26 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.593 2.196 . . . . 63.149999999999999 112.409 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 CA-C-O 119.123 -0.821 . . . . 53.140000000000001 112.518 -179.989 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 CA-C-O 121.408 0.449 . . . . 74.329999999999998 112.532 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 -45.38 1.64 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.613 2.208 . . . . 64.239999999999995 112.414 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -105.62 -26.84 11.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.208 -0.451 . . . . 73.129999999999995 110.993 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 137.33 -71.7 0.46 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.752 -0.737 . . . . 75.129999999999995 112.522 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 19.3 m -140.16 61.19 1.53 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.919 0.39 . . . . 72.329999999999998 110.872 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 mtt -130.42 74.08 80.62 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.593 0.711 . . . . 73.400000000000006 110.901 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 -7.86 22.14 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.702 2.268 . . . . 54.009999999999998 112.378 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.564 ' CH2' HD12 ' A' ' 149' ' ' LEU . 46.2 p-90 -101.94 -29.37 11.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.030000000000001 110.898 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -85.59 99.56 11.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 75.129999999999995 110.818 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -75.88 -38.77 57.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 62.399999999999999 110.831 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.34 20.66 45.25 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.736 -0.745 . . . . 41.329999999999998 112.502 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 179.38 66.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 64.299999999999997 110.932 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.555 HG21 ' HB2' ' A' ' 92' ' ' ALA . 7.3 mm -129.58 144.74 37.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.443 . . . . 75.409999999999997 111.106 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.447 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -95.33 176.98 5.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.19 -0.459 . . . . 73.209999999999994 111.144 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.447 ' H ' HG22 ' A' ' 88' ' ' THR . 0.0 OUTLIER -66.67 -38.25 86.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.239999999999995 110.858 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.87 -33.63 62.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.445 . . . . 61.210000000000001 110.847 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 8.6 mm100 -73.54 -41.33 63.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.239999999999995 110.832 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.555 ' HB2' HG21 ' A' ' 87' ' ' ILE . . . -75.32 -33.65 61.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 74.519999999999996 111.097 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -62.16 -53.47 54.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 73.230000000000004 110.863 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -38.49 91.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.120000000000005 110.892 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 92' ' ' ALA . 15.5 mt -54.99 -38.91 68.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.181 -0.463 . . . . 75.510000000000005 110.905 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.594 HD12 ' CB ' ' A' ' 121' ' ' SER . 1.6 mm? -101.26 43.7 1.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 72.310000000000002 110.892 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.5 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -66.89 -59.46 7.72 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.656 0.741 . . . . 72.439999999999998 110.978 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.81 123.11 9.76 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.697 2.264 . . . . 74.5 112.312 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 119.1 6.1 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.683 2.255 . . . . 61.439999999999998 112.34 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -155.09 108.99 2.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 74.310000000000002 110.95 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.663 ' O ' HD12 ' A' ' 168' ' ' ILE . 1.0 OUTLIER -60.92 117.17 5.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 62.399999999999999 111.153 -179.902 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 123.83 -6.49 8.96 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.734 -0.746 . . . . 53.310000000000002 112.493 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 tp -91.2 116.02 28.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 64.239999999999995 110.869 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.601 ' HB3' HD22 ' A' ' 167' ' ' LEU . 14.9 p90 -128.25 163.38 24.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 72.209999999999994 110.866 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.556 HD23 HD21 ' A' ' 96' ' ' LEU . 1.1 pp -161.18 134.83 6.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.494 . . . . 74.230000000000004 110.886 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 87.0 t -109.65 136.03 46.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 73.120000000000005 111.133 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -147.13 144.24 28.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 64.519999999999996 110.874 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -51.66 124.19 11.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.471 . . . . 73.150000000000006 110.88 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 m -57.22 116.05 3.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 63.030000000000001 110.806 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 78.8 m -69.31 -56.39 7.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.103 -0.499 . . . . 71.129999999999995 111.115 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.433 ' OD1' HG21 ' B' ' 310' ' ' ILE . 21.3 p30 -71.7 -26.57 62.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.238 -0.437 . . . . 72.230000000000004 110.866 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.71 90.24 7.23 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.768 0.794 . . . . 72.010000000000005 110.886 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 112.32 3.05 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.671 2.247 . . . . 61.299999999999997 112.336 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.58 6.0 21.95 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.718 -0.753 . . . . 54.409999999999997 112.502 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -136.16 178.76 6.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.829 0.347 . . . . 71.25 110.871 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 99.2 m-85 -128.58 160.48 32.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.446 . . . . 75.129999999999995 110.948 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 93.4 m -131.68 140.27 49.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 52.439999999999998 111.137 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.403 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.3 OUTLIER -112.13 120.59 42.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 72.530000000000001 110.859 179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 3.8 t -103.36 126.19 50.39 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.144 -0.48 . . . . 75.049999999999997 110.923 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.403 ' CG2' HD21 ' A' ' 118' ' ' LEU . 19.3 t -128.06 146.3 33.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 72.540000000000006 111.107 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.594 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -99.41 110.43 22.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 34.420000000000002 110.896 -179.899 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.49 94.05 4.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.135 -0.484 . . . . 72.219999999999999 110.913 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 66.92 28.81 8.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 74.219999999999999 110.828 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.75 -16.22 60.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.732 -0.747 . . . . 44.130000000000003 112.503 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -87.99 139.78 30.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.839 0.352 . . . . 71.230000000000004 110.888 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.437 ' O ' HG23 ' A' ' 126' ' ' VAL . 11.4 m -98.06 110.3 25.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 74.019999999999996 111.117 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -97.03 113.62 25.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 72.519999999999996 110.828 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -90.77 124.76 35.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 64.219999999999999 110.848 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.615 ' CE1' HD13 ' A' ' 163' ' ' LEU . 58.3 m-85 -115.54 108.93 17.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 71.219999999999999 110.935 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.02 142.54 58.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.14 -0.482 . . . . 73.549999999999997 110.834 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.454 HG22 HD23 ' A' ' 138' ' ' LEU . 30.8 mt -122.59 111.66 31.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.215 -0.448 . . . . 64.510000000000005 111.152 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -84.1 130.11 34.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 72.230000000000004 110.833 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.459 ' CE2' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.32 100.75 8.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 73.25 110.92 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -134.4 142.57 47.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 74.150000000000006 110.852 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.9 37.69 28.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.129 -0.487 . . . . 62.009999999999998 111.08 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.73 31.59 21.33 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.983 0.421 . . . . 71.129999999999995 110.89 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 4.0 mtmm -138.41 143.34 39.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.099 -0.5 . . . . 74.510000000000005 110.83 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.608 HD22 HD22 ' A' ' 149' ' ' LEU . 1.4 mp -104.25 151.67 23.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.25 110.953 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -169.4 144.99 3.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.238 -0.437 . . . . 72.140000000000001 110.839 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.413 HG22 HG13 ' B' ' 317' ' ' VAL . 47.8 mt -115.61 -37.83 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.103 -0.499 . . . . 74.129999999999995 111.122 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.499 ' HB3' HG11 ' B' ' 317' ' ' VAL . 9.8 p30 -88.77 -0.3 57.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 72.430000000000007 110.896 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 60.93 17.35 7.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.23 -0.441 . . . . 73.420000000000002 110.905 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -125.27 -32.48 2.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 71.400000000000006 110.864 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -113.65 104.62 17.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 71.510000000000005 111.081 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -97.74 143.86 27.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 74.340000000000003 110.97 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -119.06 175.18 5.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.05 -0.523 . . . . 71.310000000000002 110.886 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.05 -16.38 20.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 74.140000000000001 110.912 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -172.49 159.71 4.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 65.530000000000001 110.895 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.608 HD22 HD22 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -52.21 -39.19 59.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 71.299999999999997 110.978 179.916 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.8 ttt -51.03 -49.74 59.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 71.340000000000003 110.872 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.93 -39.85 87.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 64.200000000000003 110.941 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.07 -50.69 71.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 44.340000000000003 110.912 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.479 HG21 ' CH2' ' A' ' 82' ' ' TRP . 96.8 t -57.95 -44.24 86.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 74.109999999999999 111.108 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -53.27 -40.17 64.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 73.109999999999999 110.954 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -52.96 17.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.17 -0.468 . . . . 70.430000000000007 110.894 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.41 ' CE1' HD23 ' A' ' 163' ' ' LEU . 36.2 m-85 -62.27 -17.48 58.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 71.299999999999997 110.893 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.443 HG23 ' O ' ' A' ' 167' ' ' LEU . 80.9 m -85.91 -32.81 21.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 64.329999999999998 111.152 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 3.2 m -82.12 -16.3 50.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 75.040000000000006 111.154 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -177.38 131.85 0.17 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 74.409999999999997 110.872 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.41 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -50.3 -58.45 5.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 65.340000000000003 111.077 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 50.86 37.93 18.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 70.030000000000001 110.855 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 129.76 0.45 5.67 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.728 -0.748 . . . . 43.409999999999997 112.461 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.615 HD13 ' CE1' ' A' ' 129' ' ' TYR . 2.5 mm? -106.73 139.58 40.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.835 0.35 . . . . 45.140000000000001 110.975 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 53.7 t -56.79 -21.72 30.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 74.150000000000006 110.893 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.8 t -162.2 116.36 1.84 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.143 -0.48 . . . . 71.049999999999997 111.119 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.41 138.02 13.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 60.140000000000001 110.864 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.601 HD22 ' HB3' ' A' ' 104' ' ' PHE . 8.4 mt -61.34 126.71 28.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.441 . . . . 75.439999999999998 110.848 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.663 HD12 ' O ' ' A' ' 101' ' ' THR . 51.3 mt -109.71 -51.49 6.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 75.400000000000006 111.112 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' LYS . . . . . 0.412 ' HE3' HG22 ' A' ' 168' ' ' ILE . 3.8 mtmp? -136.77 139.71 29.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.562 0.696 . . . . 75.140000000000001 110.858 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.82 139.46 40.08 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.631 2.221 . . . . 61.219999999999999 112.276 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.54 84.3 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 74.120000000000005 110.885 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 29.2 m -63.95 131.01 29.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 64.140000000000001 111.106 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.5 ptt? . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 64.299999999999997 110.923 179.841 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 CA-C-O 121.471 0.484 . . . . 32.229999999999997 112.521 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 170.0 17.55 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.677 2.251 . . . . 71.0 112.334 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 42.6 mt -55.34 -45.52 76.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 74.409999999999997 110.916 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 104.15 20.52 10.36 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.734 -0.746 . . . . 54.409999999999997 112.43 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 67.0 m -127.57 139.35 52.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.885 0.374 . . . . 34.140000000000001 110.861 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -158.74 128.76 5.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 74.439999999999998 110.886 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -133.9 121.97 22.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 71.239999999999995 110.884 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -178.92 133.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 61.420000000000002 110.889 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 1.8 m -126.15 85.11 2.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.507 . . . . 65.219999999999999 110.856 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 97.5 p -60.25 -171.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.111 -0.495 . . . . 73.010000000000005 110.812 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.66 116.72 2.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 63.549999999999997 110.889 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 10.3 t -101.71 87.87 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 65.340000000000003 110.902 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -83.53 119.53 24.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 74.219999999999999 110.863 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -120.72 128.52 53.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 75.219999999999999 110.939 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.22 172.63 8.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 64.129999999999995 110.913 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 51.3 mtt180 -62.52 -16.41 55.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 74.409999999999997 110.838 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -37.78 84.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 64.010000000000005 110.893 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -104.01 -23.9 13.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 73.519999999999996 110.854 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.435 ' HB2' HD11 ' B' ' 305' ' ' LEU . 3.6 m-20 -143.28 78.89 14.57 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.619 0.723 . . . . 73.319999999999993 110.857 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -6.16 17.94 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.663 2.242 . . . . 70.209999999999994 112.35 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.7 t -93.64 27.58 2.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 64.299999999999997 111.119 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.435 HD11 ' HB2' ' B' ' 302' ' ' ASP . 36.8 mt -100.7 147.73 25.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 55.439999999999998 110.979 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.611 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.3 t -113.31 173.77 6.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 74.439999999999998 111.122 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -48.81 -36.91 17.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.204 -0.453 . . . . 65.540000000000006 110.9 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -62.45 -49.89 73.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 72.450000000000003 110.9 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.611 ' HG2' HG22 ' B' ' 306' ' ' THR . 18.5 mm-40 -64.12 -48.72 75.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 72.439999999999998 110.834 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.433 HG21 ' OD1' ' A' ' 111' ' ' ASN . 42.5 mm -61.94 -35.65 69.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 71.219999999999999 111.111 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 10.8 t -77.51 -15.71 59.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 64.340000000000003 110.813 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.41 3.62 27.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.135 -0.484 . . . . 72.129999999999995 111.082 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 313' ' ' MET . . . . . 0.426 ' HE3' ' HA ' ' B' ' 310' ' ' ILE . 0.2 OUTLIER -115.16 14.24 16.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 73.349999999999994 110.904 179.924 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 3.5 t -100.28 -30.04 12.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 114.1 -1.409 . . . . 72.340000000000003 110.845 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 64.16 156.77 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 74.310000000000002 110.818 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 141' ' ' ASP . 6.0 m -50.86 118.62 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 74.099999999999994 111.092 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -136.75 85.34 2.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.471 . . . . 72.329999999999998 110.866 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -70.77 153.92 94.59 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.519 0.676 . . . . 70.120000000000005 110.94 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 114.22 3.64 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.639 2.226 . . . . 64.319999999999993 112.353 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 CA-C-O 119.151 -0.805 . . . . 74.329999999999998 112.472 179.977 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 CA-C-O 121.39 0.439 . . . . 73.409999999999997 112.419 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -49.35 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.674 2.249 . . . . 63.450000000000003 112.367 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.63 HD22 ' HE2' ' A' ' 80' ' ' MET . 54.8 mt -109.19 63.06 0.6 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.453 . . . . 72.010000000000005 110.84 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.27 56.29 3.66 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.712 -0.756 . . . . 34.100000000000001 112.49 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 6.4 p 178.92 33.87 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.924 0.392 . . . . 72.430000000000007 110.847 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.63 ' HE2' HD22 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -150.39 81.54 6.62 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.51 0.672 . . . . 61.340000000000003 110.887 179.897 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 -8.16 22.9 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.679 2.253 . . . . 52.520000000000003 112.334 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.546 ' CH2' HD12 ' A' ' 149' ' ' LEU . 56.1 p-90 -81.88 -18.79 42.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.218 -0.446 . . . . 74.340000000000003 110.911 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.554 ' HD2' HD12 ' A' ' 77' ' ' LEU . 11.8 t80 -97.59 99.28 10.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.44 . . . . 74.510000000000005 110.889 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -75.99 -39.48 55.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 73.310000000000002 110.871 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 56.84 22.25 40.3 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 74.540000000000006 112.508 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.21 69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.773 0.32 . . . . 61.340000000000003 110.886 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.403 HG21 ' HB2' ' A' ' 92' ' ' ALA . 11.6 mm -133.12 144.44 36.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 72.400000000000006 111.125 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.458 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -98.18 168.89 9.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.15 -0.477 . . . . 73.010000000000005 111.105 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.458 ' H ' HG22 ' A' ' 88' ' ' THR . 5.5 ptm180 -58.93 -39.49 81.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 74.540000000000006 110.9 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -71.37 -35.62 71.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 74.019999999999996 110.963 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -72.93 -40.47 65.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.072 -0.513 . . . . 60.310000000000002 110.96 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.403 ' HB2' HG21 ' A' ' 87' ' ' ILE . . . -75.63 -33.74 60.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 73.040000000000006 111.138 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -61.67 -53.09 60.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.244 -0.434 . . . . 75.530000000000001 110.845 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -38.21 90.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 73.439999999999998 110.89 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.1 mt -55.62 -38.07 69.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.479 . . . . 72.230000000000004 110.967 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.658 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -100.0 43.27 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 73.439999999999998 110.933 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.498 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.62 -59.87 5.27 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.686 0.755 . . . . 63.130000000000003 110.942 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.2 Cg_endo -69.77 123.56 10.22 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.705 2.27 . . . . 72.510000000000005 112.332 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 116.87 4.76 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.719 2.28 . . . . 61.43 112.37 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -154.98 109.33 2.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 62.329999999999998 110.9 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.688 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.2 OUTLIER -62.09 111.64 2.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 52.439999999999998 111.164 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 131.03 -9.21 5.71 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.797 -0.716 . . . . 60.32 112.514 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -87.32 111.65 21.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.873 0.368 . . . . 74.200000000000003 110.885 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -123.59 163.63 20.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 74.219999999999999 110.908 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.653 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -160.45 135.74 7.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.16 -0.473 . . . . 72.439999999999998 110.917 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 87.8 t -109.97 137.04 44.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.236 -0.438 . . . . 70.439999999999998 111.063 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.7 ptt180 -150.15 144.4 25.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 71.540000000000006 110.867 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -54.9 125.71 21.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.484 . . . . 61.420000000000002 110.863 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.96 116.57 2.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 62.020000000000003 110.795 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.5 m -69.95 -29.88 67.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 63.340000000000003 111.111 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -102.53 0.35 33.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 73.530000000000001 110.881 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.428 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -139.7 94.88 9.04 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.657 0.742 . . . . 71.200000000000003 110.965 -179.925 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.7 Cg_endo -69.79 113.02 3.24 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.673 2.249 . . . . 75.519999999999996 112.354 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.8 -8.87 23.64 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.718 -0.753 . . . . 53.140000000000001 112.418 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.09 163.97 15.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.833 0.349 . . . . 75.109999999999999 110.87 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -118.32 160.08 22.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 60.329999999999998 110.953 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.553 HG23 ' HE1' ' B' ' 314' ' ' PTR . 59.6 m -137.02 127.94 27.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 72.010000000000005 111.141 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.58 125.06 46.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 73.420000000000002 110.973 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 17.9 t -109.24 124.26 50.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.225 -0.443 . . . . 71.340000000000003 110.899 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.1 t -123.5 153.39 29.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.471 . . . . 73.349999999999994 111.121 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.658 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -104.93 112.49 25.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 44.310000000000002 110.879 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.78 94.59 4.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.457 . . . . 54.450000000000003 110.926 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 67.16 29.67 7.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 60.5 110.971 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.74 -14.1 63.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.747 -0.739 . . . . 74.099999999999994 112.514 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.69 141.05 28.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 73.409999999999997 110.876 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.666 ' O ' HD13 ' B' ' 294' ' ' LEU . 9.0 m -100.83 111.1 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 74.439999999999998 111.149 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -102.23 123.97 46.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 74.099999999999994 110.854 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -101.15 132.18 46.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 71.310000000000002 110.902 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -116.17 122.73 45.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 61.119999999999997 110.921 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.579 ' O ' HG23 ' A' ' 140' ' ' ILE . 14.1 tpt180 -72.17 136.02 46.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 71.209999999999994 110.909 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 54.1 mt -117.74 107.08 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 74.040000000000006 111.137 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -83.0 128.78 34.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.448 . . . . 71.400000000000006 110.896 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.464 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.1 OUTLIER -113.7 103.04 10.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.442 . . . . 73.040000000000006 110.917 -179.852 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -140.85 142.64 34.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 73.239999999999995 110.847 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.72 39.6 24.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 71.340000000000003 111.095 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 56.96 25.15 10.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 64.530000000000001 110.864 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.8 mtmm -132.0 152.75 50.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 75.540000000000006 110.874 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.464 HD21 ' CE2' ' A' ' 133' ' ' TYR . 1.1 mt -115.86 150.49 36.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.434 . . . . 72.5 110.92 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 7.9 t -168.4 145.35 3.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 71.349999999999994 110.852 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.579 HG23 ' O ' ' A' ' 130' ' ' ARG . 35.4 mt -115.61 -32.09 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 74.420000000000002 111.089 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.482 ' CB ' HG21 ' B' ' 317' ' ' VAL . 36.8 t0 -89.37 1.61 55.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 70.209999999999994 110.8 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 60.31 18.18 7.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 72.549999999999997 110.852 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -132.22 -38.81 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 74.129999999999995 110.931 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.3 t -100.73 104.72 16.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 54.439999999999998 111.156 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -100.84 141.11 34.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 74.209999999999994 110.946 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.463 ' CD1' HD12 ' A' ' 152' ' ' LEU . 52.0 m-85 -116.66 173.97 6.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 72.340000000000003 110.85 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.28 -17.56 22.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.094 -0.503 . . . . 74.239999999999995 110.941 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -170.49 158.71 6.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.08 -0.509 . . . . 62.210000000000001 110.877 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.546 HD12 ' CH2' ' A' ' 82' ' ' TRP . 0.0 OUTLIER -53.05 -39.42 63.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 63.520000000000003 110.925 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.9 ttt -51.29 -47.92 62.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 72.540000000000006 110.858 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.23 -41.59 81.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.918 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.463 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.8 OUTLIER -55.93 -48.56 75.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 71.439999999999998 110.905 -179.949 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.511 HG21 ' CH2' ' A' ' 82' ' ' TRP . 87.9 t -61.81 -40.23 86.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 74.209999999999994 111.165 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -56.67 -38.44 72.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.493 . . . . 74.519999999999996 110.864 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -51.13 25.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 65.349999999999994 110.821 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.464 ' CD1' HD13 ' A' ' 163' ' ' LEU . 36.2 m-85 -64.28 -20.94 66.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 72.430000000000007 110.925 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.511 ' OG1' HD12 ' A' ' 167' ' ' LEU . 85.1 m -84.44 -29.48 26.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.118 -0.492 . . . . 71.019999999999996 111.122 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 89.0 m -79.44 -24.24 42.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.429 . . . . 64.430000000000007 111.167 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -162.54 166.15 25.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 70.409999999999997 110.907 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.89 -55.62 16.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 74.530000000000001 111.121 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 59.03 21.62 9.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.282 -0.417 . . . . 65.299999999999997 110.837 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 107.62 13.66 19.88 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.76 -0.733 . . . . 62.219999999999999 112.544 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.464 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.9 mp -108.15 136.25 48.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.882 0.372 . . . . 71.099999999999994 110.891 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 26.3 t -51.48 -30.25 19.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 70.049999999999997 110.942 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.46 ' HB ' HG22 ' A' ' 101' ' ' THR . 2.9 t -151.65 119.39 6.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 64.019999999999996 111.195 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.76 153.24 2.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.256 -0.429 . . . . 75.430000000000007 110.953 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.511 HD12 ' OG1' ' A' ' 157' ' ' THR . 6.3 mt -69.44 133.44 47.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.431 . . . . 70.129999999999995 110.996 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.688 HD12 ' O ' ' A' ' 101' ' ' THR . 22.4 mt -127.2 -51.23 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 65.310000000000002 111.158 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt -126.2 118.92 23.51 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.579 0.704 . . . . 72.430000000000007 110.892 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 131.91 22.31 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.712 2.275 . . . . 73.219999999999999 112.375 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 83.67 0.53 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 73.299999999999997 110.872 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 31.6 m -64.71 144.92 14.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.44 . . . . 75.230000000000004 111.162 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 52.409999999999997 110.872 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 CA-C-O 121.486 0.492 . . . . 63.32 112.458 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 169.44 18.85 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.711 2.274 . . . . 73.310000000000002 112.37 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.86 -42.33 71.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.222 -0.445 . . . . 54.32 110.91 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 78.52 20.76 70.96 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.677 -0.773 . . . . 62.020000000000003 112.559 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 2.7 p -84.62 109.14 17.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 65.140000000000001 110.807 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 14.5 mttm -153.74 133.98 13.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.128 -0.487 . . . . 64.530000000000001 110.958 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -177.88 145.69 0.4 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.254 -0.43 . . . . 73.239999999999995 110.827 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -161.55 78.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 64.329999999999998 110.915 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -178.98 79.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.143 -0.48 . . . . 75.310000000000002 110.869 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.72 111.98 6.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 74.109999999999999 110.845 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.666 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER -164.05 108.96 1.01 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.173 -0.467 . . . . 72.450000000000003 110.994 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 11.1 p -105.35 88.61 2.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 75.340000000000003 110.809 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -81.63 151.13 27.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.141 -0.481 . . . . 75.019999999999996 110.973 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 297' ' ' LYS . . . . . 0.426 ' O ' ' HE1' ' B' ' 313' ' ' MET . 0.0 OUTLIER -148.2 129.22 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 71.310000000000002 110.855 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.08 159.28 15.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 70.519999999999996 110.831 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 45.4 mtt180 -60.15 -18.48 47.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.094 -0.503 . . . . 71.5 110.873 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.05 -43.41 87.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 74.040000000000006 110.863 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.37 -23.18 17.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 70.120000000000005 110.918 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.408 ' HB2' HD11 ' B' ' 305' ' ' LEU . 53.6 m-20 -144.52 77.45 13.82 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.624 0.726 . . . . 73.030000000000001 110.819 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.84 -5.8 17.12 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.703 2.268 . . . . 44.439999999999998 112.3 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.3 t -92.63 27.52 2.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.232 -0.44 . . . . 72.0 111.207 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.408 HD11 ' HB2' ' B' ' 302' ' ' ASP . 24.4 mt -103.92 136.71 43.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 73.25 110.88 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.638 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.1 t -104.5 171.99 7.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 73.019999999999996 111.149 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -49.35 -36.82 22.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.272 -0.422 . . . . 74.430000000000007 110.885 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.86 -52.08 66.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.197 -0.456 . . . . 73.230000000000004 110.932 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.638 ' HG2' HG22 ' B' ' 306' ' ' THR . 18.8 mm-40 -64.15 -52.56 58.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.474 . . . . 71.340000000000003 110.932 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.621 HG22 ' HE2' ' B' ' 314' ' ' PTR . 48.0 mm -55.85 -54.52 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 74.510000000000005 111.208 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 33.3 t -59.43 -21.38 59.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 73.430000000000007 110.872 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.14 3.9 25.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 72.25 111.143 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 313' ' ' MET . . . . . 0.473 ' HE2' HD13 ' B' ' 310' ' ' ILE . 1.2 mtm -115.58 14.33 16.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 63.520000000000003 110.87 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.621 ' HE2' HG22 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.43 -35.98 6.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.139 -1.391 . . . . 53.240000000000002 110.868 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.4 m 66.49 136.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 75.310000000000002 110.922 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.482 HG21 ' CB ' ' A' ' 141' ' ' ASP . 5.8 m -51.25 121.97 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 72.450000000000003 111.142 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -128.4 78.41 1.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 64.530000000000001 110.86 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 23.7 mtmt -60.31 160.45 17.54 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.655 0.74 . . . . 63.409999999999997 110.844 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 112.3 3.04 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.628 2.219 . . . . 74.049999999999997 112.425 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 CA-C-O 119.143 -0.809 . . . . 52.219999999999999 112.488 179.979 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 CA-C-O 121.458 0.477 . . . . 63.020000000000003 112.462 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.79 -39.94 5.86 Favored 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 122.653 2.236 . . . . 61.409999999999997 112.306 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.76 -29.65 5.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.288 -0.415 . . . . 72.349999999999994 110.918 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 158.43 -73.37 0.23 Allowed Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.714 -0.755 . . . . 60.43 112.46 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 18.6 m -132.89 59.58 1.73 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 65.5 110.814 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 32.9 mtt -146.1 68.1 12.43 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.567 0.699 . . . . 55.130000000000003 110.867 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -7.89 22.21 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.673 2.249 . . . . 72.209999999999994 112.272 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.456 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 38.9 p-90 -101.57 -30.51 11.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 74.239999999999995 110.909 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -86.41 99.09 11.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.41 . . . . 74.129999999999995 110.886 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.4 m80 -76.56 -40.39 49.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 71.109999999999999 110.903 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.83 24.86 54.98 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 75.230000000000004 112.506 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.96 66.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.743 0.306 . . . . 74.329999999999998 110.899 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 14.2 mm -129.74 144.32 38.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 55.210000000000001 111.131 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.465 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -95.49 170.49 9.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 45.409999999999997 111.105 179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.465 ' H ' HG22 ' A' ' 88' ' ' THR . 1.9 ppt_? -60.9 -39.45 89.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 73.450000000000003 110.82 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -74.05 -33.78 63.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 73.329999999999998 110.9 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -70.82 -40.83 72.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 74.140000000000001 110.926 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.468 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -75.18 -34.13 61.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 45.039999999999999 111.135 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -60.07 -52.98 63.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 62.340000000000003 110.861 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.75 -36.35 82.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 75.430000000000007 110.929 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 92' ' ' ALA . 11.1 mt -55.01 -38.26 67.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.131 -0.486 . . . . 72.430000000000007 110.92 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.69 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.6 mm? -102.03 43.76 1.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 71.340000000000003 110.929 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.502 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.54 -59.68 6.67 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.631 0.729 . . . . 71.430000000000007 110.897 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.81 123.61 10.25 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.64 2.227 . . . . 75.230000000000004 112.373 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 116.82 4.74 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.674 2.249 . . . . 51.439999999999998 112.351 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -154.87 115.16 3.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 72.349999999999994 110.939 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.685 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.4 OUTLIER -66.6 111.69 3.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.166 -0.47 . . . . 73.519999999999996 111.165 -179.888 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.19 -5.07 6.37 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.705 -0.759 . . . . 74.049999999999997 112.44 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.428 HD12 ' O ' ' A' ' 169' ' ' LYS . 2.9 tp -90.6 113.15 25.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.838 0.352 . . . . 72.209999999999994 110.894 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.653 ' HB2' HD11 ' A' ' 118' ' ' LEU . 16.6 p90 -124.38 168.42 13.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 73.400000000000006 110.875 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.599 HD23 HD21 ' A' ' 96' ' ' LEU . 0.7 OUTLIER -164.03 137.14 5.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 64.319999999999993 110.934 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.485 HG11 HD22 ' A' ' 149' ' ' LEU . 89.5 t -110.65 135.73 48.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 72.439999999999998 111.164 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -149.3 143.01 25.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 70.310000000000002 110.866 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -54.88 124.08 15.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.181 -0.463 . . . . 62.520000000000003 110.885 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.2 m -56.37 115.91 2.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.078 -0.51 . . . . 74.019999999999996 110.855 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.4 m -68.61 -56.28 8.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 62.109999999999999 111.13 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.409 ' ND2' HG23 ' B' ' 310' ' ' ILE . 26.0 p30 -68.19 -19.55 64.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 71.420000000000002 110.963 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.429 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 1.3 m-85 -124.75 93.15 46.61 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.673 0.749 . . . . 74.150000000000006 110.934 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 54.0 Cg_endo -69.71 119.84 6.72 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.668 2.245 . . . . 72.340000000000003 112.409 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.73 -10.45 23.42 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.792 -0.718 . . . . 62.43 112.473 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -119.46 -178.61 3.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.802 0.334 . . . . 71.109999999999999 110.838 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -130.59 162.15 29.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 70.430000000000007 110.885 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 96.4 m -130.32 125.33 34.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.111 -0.495 . . . . 63.119999999999997 111.195 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.653 HD11 ' HB2' ' A' ' 104' ' ' PHE . 30.2 tp -98.57 112.6 24.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.277 -0.419 . . . . 74.349999999999994 110.881 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.1 m -101.04 126.35 47.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 72.0 110.877 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.524 HG21 ' CD1' ' A' ' 163' ' ' LEU . 11.7 t -127.55 151.21 34.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 53.539999999999999 111.116 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.69 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -100.27 112.62 24.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 70.549999999999997 110.845 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.96 94.27 4.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 72.0 110.909 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 65.58 25.52 11.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.030000000000001 110.897 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.9 8.85 55.19 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 51.030000000000001 112.535 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -110.55 139.09 46.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.768 0.318 . . . . 64.319999999999993 110.874 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.607 ' O ' HD13 ' B' ' 294' ' ' LEU . 69.3 t -95.17 101.21 12.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 73.030000000000001 111.162 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -90.24 110.23 21.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 73.549999999999997 110.88 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -89.03 124.52 34.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 60.200000000000003 110.84 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.53 ' HB3' HD13 ' A' ' 140' ' ' ILE . 66.3 m-85 -113.93 104.49 12.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 62.210000000000001 110.908 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -53.76 133.66 42.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.08 -0.509 . . . . 70.439999999999998 110.845 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 65.2 mt -113.13 106.95 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.456 . . . . 63.210000000000001 111.153 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.1 ttm -76.69 129.31 36.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 63.219999999999999 110.942 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -114.88 115.97 27.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 74.030000000000001 110.972 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -149.58 137.03 20.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 64.109999999999999 110.869 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.46 36.11 24.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 62.520000000000003 111.101 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.57 25.41 14.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 73.010000000000005 110.813 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -126.24 144.02 50.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 71.310000000000002 110.892 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.9 mp -106.5 150.7 25.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.258 -0.428 . . . . 73.420000000000002 110.913 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -168.26 134.84 2.0 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.184 -0.462 . . . . 72.510000000000005 110.855 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.597 ' CG2' HG13 ' B' ' 317' ' ' VAL . 50.0 mt -110.77 -33.48 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 74.340000000000003 111.138 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.789 ' HB3' HG21 ' B' ' 317' ' ' VAL . 3.4 p30 -95.48 9.8 38.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.114 -0.494 . . . . 74.129999999999995 110.864 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 6.7 pt-20 45.48 31.29 0.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.540000000000006 110.973 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -131.86 -39.47 1.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.079 -0.51 . . . . 70.430000000000007 110.86 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.527 HG12 ' OD1' ' A' ' 141' ' ' ASP . 2.7 p -118.52 104.55 16.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 64.430000000000007 111.136 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -91.91 149.83 21.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 74.219999999999999 110.891 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -120.09 173.76 6.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 64.049999999999997 110.887 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -93.84 -18.19 22.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 52.25 110.886 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -172.05 158.7 4.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 64.109999999999999 110.888 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.485 HD22 HG11 ' A' ' 106' ' ' VAL . 0.6 OUTLIER -51.19 -36.02 39.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 74.439999999999998 110.881 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.5 ttt -52.47 -51.14 60.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 63.439999999999998 110.928 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.99 -40.05 90.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 72.150000000000006 110.951 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.71 -49.71 72.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.212 -0.449 . . . . 73.209999999999994 110.927 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.64 HG13 HD12 ' A' ' 167' ' ' LEU . 96.5 t -59.04 -44.62 91.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 72.140000000000001 111.18 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -52.97 -38.99 62.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.102 -0.499 . . . . 70.549999999999997 110.837 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -53.43 16.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 62.240000000000002 110.882 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.73 ' CE1' HD23 ' A' ' 163' ' ' LEU . 51.4 m-85 -62.65 -17.27 60.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 55.539999999999999 110.896 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 99.6 m -85.83 -32.46 21.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 70.120000000000005 111.15 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 16.2 m -79.68 -22.49 43.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 74.239999999999995 111.17 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -165.88 161.68 17.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 75.400000000000006 110.893 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.31 -58.35 6.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 72.519999999999996 111.108 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.01 16.6 9.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.256 -0.429 . . . . 52.509999999999998 110.873 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 115.3 1.45 21.95 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.695 -0.764 . . . . 62.509999999999998 112.467 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.73 HD23 ' CE1' ' A' ' 156' ' ' TYR . 0.9 OUTLIER -93.41 140.39 29.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.801 0.334 . . . . 72.010000000000005 110.889 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 34.6 t -51.06 -30.56 16.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.201 -0.454 . . . . 73.120000000000005 110.848 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.6 t -158.66 125.11 4.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.246 -0.434 . . . . 55.140000000000001 111.183 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -50.77 146.22 6.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 74.439999999999998 110.857 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.64 HD12 HG13 ' A' ' 153' ' ' VAL . 7.3 mt -65.04 134.78 54.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 74.310000000000002 110.899 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.685 HD12 ' O ' ' A' ' 101' ' ' THR . 25.1 mt -127.13 -51.17 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 52.329999999999998 111.11 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 169' ' ' LYS . . . . . 0.428 ' O ' HD12 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -127.77 118.82 21.19 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.556 0.693 . . . . 63.299999999999997 110.904 179.838 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 141.96 46.81 Favored 'Trans proline' 0 C--O 1.232 0.215 0 C-N-CA 122.724 2.283 . . . . 64.010000000000005 112.375 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 171' ' ' LYS . . . . . 0.416 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -70.63 82.51 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.237 -0.438 . . . . 50.520000000000003 110.923 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 13.5 m -65.0 124.76 20.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 75.099999999999994 111.124 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.2 ptm . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 74.219999999999999 110.887 179.911 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 CA-C-O 121.43 0.461 . . . . 63.350000000000001 112.473 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.86 169.65 18.55 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.673 2.249 . . . . 54.030000000000001 112.311 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.11 -44.98 64.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 63.149999999999999 110.928 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 103.44 -21.44 39.19 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.711 -0.757 . . . . 72.129999999999995 112.519 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.2 115.79 18.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.86 0.362 . . . . 64.200000000000003 110.867 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 22.8 mttt -147.68 146.85 29.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 72.420000000000002 110.953 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -150.64 101.65 2.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 54.439999999999998 110.932 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -175.11 137.24 0.4 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 74.140000000000001 110.868 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -174.13 141.35 0.75 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.482 . . . . 30.219999999999999 110.898 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 99.7 p -68.96 -171.96 0.35 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.111 -0.495 . . . . 65.310000000000002 110.905 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.607 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER -152.22 104.39 2.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 72.420000000000002 110.94 179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.2 t -96.65 88.64 4.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.161 -0.472 . . . . 63.350000000000001 110.885 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -77.66 147.87 35.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.495 . . . . 73.209999999999994 110.904 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -151.39 129.54 11.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 72.239999999999995 110.929 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.84 175.0 5.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 62.409999999999997 110.843 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 36.4 mtt180 -64.24 -15.5 60.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.094 -0.503 . . . . 70.439999999999998 110.842 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.16 -42.75 99.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 75.030000000000001 110.836 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -102.43 -10.75 19.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.165 -0.47 . . . . 74.319999999999993 110.931 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.525 ' HB2' HD11 ' B' ' 305' ' ' LEU . 10.4 m-20 -156.83 77.62 4.06 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.592 0.71 . . . . 72.420000000000002 110.862 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -6.26 18.18 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.712 2.275 . . . . 63.049999999999997 112.337 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.8 t -93.31 27.15 2.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 75.340000000000003 111.135 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.525 HD11 ' HB2' ' B' ' 302' ' ' ASP . 34.8 mt -103.98 136.84 42.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 74.109999999999999 110.947 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.615 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.7 t -103.4 174.24 5.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 42.039999999999999 111.13 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -49.87 -34.37 19.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 73.040000000000006 110.895 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 308' ' ' GLU . . . . . 0.443 ' H ' HG23 ' B' ' 306' ' ' THR . 4.0 tp10 -64.95 -48.95 72.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.482 . . . . 71.540000000000006 110.921 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.615 ' HG2' HG22 ' B' ' 306' ' ' THR . 21.3 mm-40 -64.89 -52.22 57.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.074 -0.512 . . . . 75.430000000000007 110.872 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.409 HG23 ' ND2' ' A' ' 111' ' ' ASN . 43.9 mm -57.17 -53.28 45.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 72.219999999999999 111.145 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 46.8 m -63.67 -18.44 63.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 64.519999999999996 110.792 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.38 2.99 29.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 62.240000000000002 111.168 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.7 mtt -114.01 14.38 18.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 62.420000000000002 110.925 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 13.2 p -116.51 -26.61 7.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.127 -1.397 . . . . 73.120000000000005 110.903 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 62.86 161.56 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.098 -0.501 . . . . 53.420000000000002 110.814 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.789 HG21 ' HB3' ' A' ' 141' ' ' ASP . 15.3 m -68.6 134.47 30.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.108 -0.497 . . . . 62.200000000000003 111.15 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -132.14 74.38 1.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 73.019999999999996 110.91 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 34.1 mttt -67.43 153.72 94.34 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.595 0.712 . . . . 72.049999999999997 110.876 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 113.82 3.5 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.659 2.239 . . . . 75.310000000000002 112.378 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 CA-C-O 119.122 -0.821 . . . . 43.420000000000002 112.47 179.99 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 CA-C-O 121.433 0.463 . . . . 32.020000000000003 112.502 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.699 ' HB2' HD23 ' A' ' 77' ' ' LEU . 53.7 Cg_endo -69.75 -39.3 6.69 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.703 2.269 . . . . 72.400000000000006 112.34 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.699 HD23 ' HB2' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -151.24 27.18 0.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 75.099999999999994 110.862 179.978 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 159.41 -100.19 0.19 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.718 -0.753 . . . . 61.200000000000003 112.458 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 97.3 p -153.28 64.96 0.76 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.89 0.376 . . . . 73.549999999999997 110.872 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.89 73.94 78.82 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.599 0.714 . . . . 61.509999999999998 110.917 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -7.75 21.85 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.68 2.253 . . . . 74.040000000000006 112.325 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.437 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 39.0 p-90 -102.86 -31.01 10.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.271 -0.422 . . . . 75.340000000000003 110.892 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -86.44 102.06 13.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.239999999999995 110.893 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.0 m80 -76.25 -36.63 58.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 61.310000000000002 110.891 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.39 18.75 37.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.736 -0.745 . . . . 40.25 112.554 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.51 78.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 64.530000000000001 110.872 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.498 HG21 ' HB2' ' A' ' 92' ' ' ALA . 13.4 mm -139.21 144.28 29.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 75.200000000000003 111.103 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.449 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -96.11 176.01 6.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.103 -0.499 . . . . 75.519999999999996 111.195 179.933 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.449 ' H ' HG22 ' A' ' 88' ' ' THR . 5.5 ppt_? -65.44 -39.12 91.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.224 -0.444 . . . . 74.430000000000007 110.908 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -74.61 -33.07 62.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.165 -0.47 . . . . 62.399999999999999 110.883 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 9.7 mm100 -71.77 -43.06 66.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 75.010000000000005 110.878 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.498 ' HB2' HG21 ' A' ' 87' ' ' ILE . . . -75.04 -33.82 61.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 65.540000000000006 111.126 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -60.25 -53.28 59.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 63.329999999999998 110.892 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -36.58 83.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.489 . . . . 72.25 110.892 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' A' ' 92' ' ' ALA . 12.0 mt -55.01 -38.18 67.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.188 -0.46 . . . . 45.229999999999997 110.88 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.676 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.2 mm? -102.03 43.75 1.05 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.228 -0.442 . . . . 71.010000000000005 110.917 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.62 -59.91 6.27 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.679 0.752 . . . . 74.439999999999998 110.975 179.933 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.7 Cg_endo -69.83 123.25 9.89 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.631 2.22 . . . . 73.329999999999998 112.326 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 117.58 5.17 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.677 2.251 . . . . 71.450000000000003 112.331 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -154.81 108.17 2.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.176 -0.465 . . . . 61.109999999999999 110.905 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.659 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -60.79 112.79 2.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 74.219999999999999 111.19 -179.923 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.09 -6.9 6.39 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.745 -0.741 . . . . 63.439999999999998 112.495 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.13 115.44 27.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.855 0.36 . . . . 72.140000000000001 110.924 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -126.77 164.36 21.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 74.010000000000005 110.882 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.587 HD23 HD21 ' A' ' 96' ' ' LEU . 0.7 OUTLIER -161.13 137.93 8.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 72.299999999999997 110.879 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.437 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 92.3 t -110.3 140.27 30.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 65.040000000000006 111.08 179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -153.15 145.58 24.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 73.109999999999999 110.866 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.53 125.02 13.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 72.140000000000001 110.895 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.5 m -58.38 113.19 1.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 72.340000000000003 110.774 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.58 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.9 m -68.92 -56.27 8.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 63.240000000000002 111.097 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.637 ' CG ' HD12 ' B' ' 310' ' ' ILE . 34.2 m-80 -65.02 -27.88 69.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 63.229999999999997 110.917 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -117.64 94.62 46.2 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.675 0.75 . . . . 72.25 110.927 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 118.09 5.48 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.656 2.237 . . . . 64.209999999999994 112.338 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.57 -1.32 24.85 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.757 -0.735 . . . . 54.100000000000001 112.485 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -129.06 -173.41 2.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.799 0.333 . . . . 70.109999999999999 110.872 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -134.52 166.61 22.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 74.120000000000005 110.88 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.4 HG23 ' HE1' ' B' ' 314' ' ' PTR . 57.6 m -138.38 141.6 39.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.098 -0.501 . . . . 64.040000000000006 111.14 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.591 ' CD2' HD11 ' A' ' 163' ' ' LEU . 0.4 OUTLIER -110.96 118.23 35.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 75.319999999999993 110.949 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.5 m -101.59 125.92 48.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.44 . . . . 72.530000000000001 110.892 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.412 HG21 HD12 ' A' ' 163' ' ' LEU . 15.4 t -126.1 150.91 31.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 63.439999999999998 111.12 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.676 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.99 111.64 24.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.420000000000002 110.878 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.73 93.11 3.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.475 . . . . 75.239999999999995 110.931 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 66.81 29.8 8.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 74.340000000000003 110.936 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.9 -14.0 63.17 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.763 -0.732 . . . . 74.430000000000007 112.508 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -88.14 139.29 30.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 71.230000000000004 110.919 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.647 ' O ' HD13 ' B' ' 294' ' ' LEU . 95.6 t -100.09 111.27 29.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 74.420000000000002 111.138 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.541 ' OE2' HD11 ' B' ' 294' ' ' LEU . 5.0 mm-40 -100.96 124.18 46.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 61.140000000000001 110.928 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -101.6 124.76 47.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 74.409999999999997 110.825 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.61 ' CE1' HD13 ' A' ' 163' ' ' LEU . 72.9 m-85 -112.3 112.73 24.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.467 . . . . 71.329999999999998 110.968 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -62.2 139.27 58.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 63.509999999999998 110.883 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.456 ' CG2' HD23 ' A' ' 138' ' ' LEU . 60.2 mt -119.69 109.61 26.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 72.140000000000001 111.104 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.38 123.29 30.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 64.319999999999993 110.89 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.481 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -112.4 98.23 7.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 72.439999999999998 110.951 -179.901 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -131.47 142.61 50.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 74.5 110.865 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.65 36.1 26.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 64.310000000000002 111.113 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.51 26.44 16.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 60.420000000000002 110.872 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -131.34 139.33 49.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 71.299999999999997 110.907 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.481 HD21 ' CE2' ' A' ' 133' ' ' TYR . 4.0 mp -102.08 150.46 23.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.465 . . . . 74.310000000000002 110.93 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -167.79 138.37 2.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.209999999999994 110.875 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.561 HG22 HG13 ' B' ' 317' ' ' VAL . 50.3 mt -112.93 -34.87 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 73.129999999999995 111.071 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.616 ' HB3' HG21 ' B' ' 317' ' ' VAL . 7.6 p30 -89.14 -1.67 58.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.254 -0.43 . . . . 65.129999999999995 110.853 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 61.12 17.49 8.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 73.209999999999994 110.805 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -127.21 -33.36 2.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.219999999999999 110.915 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -113.36 104.86 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 71.430000000000007 111.103 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -97.19 145.65 25.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 73.510000000000005 111.009 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.448 ' CD1' HD12 ' A' ' 152' ' ' LEU . 53.8 m-85 -118.52 178.1 4.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 74.409999999999997 110.806 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.68 -15.63 17.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.112 -0.495 . . . . 74.340000000000003 110.912 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -165.48 172.2 12.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 74.239999999999995 110.871 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.405 ' H ' HD12 ' A' ' 149' ' ' LEU . 0.6 OUTLIER -74.71 -23.88 58.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 75.109999999999999 110.901 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -57.19 11.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 65.030000000000001 110.866 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -65.08 -35.33 80.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 73.310000000000002 110.908 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.448 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.57 -47.57 76.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.430000000000007 110.929 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.472 HG13 HD12 ' A' ' 167' ' ' LEU . 75.2 t -64.99 -39.48 85.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 54.229999999999997 111.142 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -54.43 -37.83 65.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.109 -0.496 . . . . 74.239999999999995 110.958 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.03 -44.84 62.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.107 -0.497 . . . . 72.400000000000006 110.88 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.474 ' CE1' HD23 ' A' ' 163' ' ' LEU . 38.3 m-85 -67.96 -22.09 65.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.451 . . . . 75.200000000000003 110.898 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.496 HG23 ' O ' ' A' ' 167' ' ' LEU . 55.5 m -84.24 -30.04 26.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 61.530000000000001 111.164 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 19.2 m -78.96 -25.83 43.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.213 -0.449 . . . . 62.399999999999999 111.118 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.66 161.68 29.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.194 -0.457 . . . . 41.210000000000001 110.868 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.1 -58.32 6.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.419 . . . . 43.5 111.103 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 60.2 19.51 8.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.459 . . . . 72.409999999999997 110.907 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 114.43 0.76 23.44 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.696 -0.764 . . . . 73.540000000000006 112.449 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.61 HD13 ' CE1' ' A' ' 129' ' ' TYR . 3.0 mm? -93.83 139.2 31.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.888 0.375 . . . . 75.409999999999997 110.918 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 36.0 t -51.27 -30.29 17.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 74.120000000000005 110.822 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.1 t -156.42 125.7 6.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 42.020000000000003 111.137 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -50.73 142.22 11.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.227 -0.442 . . . . 74.340000000000003 110.819 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.496 ' O ' HG23 ' A' ' 157' ' ' THR . 8.6 mt -64.31 134.62 55.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.14 -0.482 . . . . 64.219999999999999 110.847 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.659 HD12 ' O ' ' A' ' 101' ' ' THR . 28.8 mt -121.77 -51.25 3.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 71.420000000000002 111.112 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -132.42 126.36 20.19 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.595 0.712 . . . . 74.120000000000005 110.887 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.85 140.58 42.69 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.662 2.241 . . . . 64.439999999999998 112.343 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.09 83.48 0.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.274 -0.421 . . . . 75.349999999999994 110.931 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 29.1 m -64.46 129.91 28.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 71.439999999999998 111.173 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.4 ptt? . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 52.229999999999997 110.899 179.949 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 CA-C-O 121.469 0.483 . . . . 43.520000000000003 112.474 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 169.41 18.92 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.599 2.199 . . . . 74.540000000000006 112.352 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.54 -47.59 66.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.152 -0.476 . . . . 72.109999999999999 110.962 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 95.23 -21.13 45.91 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.733 -0.746 . . . . 44.409999999999997 112.511 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 5.6 p -53.44 130.8 36.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.979 0.418 . . . . 73.409999999999997 110.834 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -144.01 152.34 40.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.083 -0.508 . . . . 65.230000000000004 110.882 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.5 172.58 6.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.225 -0.443 . . . . 73.010000000000005 110.872 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -171.01 65.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 71.140000000000001 110.925 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 35.1 t -174.32 74.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.187 -0.461 . . . . 51.43 110.894 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 9.6 t -134.14 103.41 5.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 74.340000000000003 110.835 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.647 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.3 OUTLIER -163.96 112.7 1.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 74.219999999999999 110.926 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.91 88.5 2.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 70.530000000000001 110.801 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -74.63 149.23 40.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.153 -0.476 . . . . 75.230000000000004 110.92 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 297' ' ' LYS . . . . . 0.407 ' O ' ' HE1' ' B' ' 313' ' ' MET . 0.4 OUTLIER -144.55 129.09 18.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.106 -0.497 . . . . 75.129999999999995 110.904 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 298' ' ' SER . . . . . 0.58 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -91.79 157.02 17.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 73.409999999999997 110.852 -179.919 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -59.31 -18.94 42.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.093 -0.503 . . . . 74.129999999999995 110.869 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -36.65 84.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 72.400000000000006 110.85 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -97.7 -24.55 15.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 72.120000000000005 110.893 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.428 ' HB2' HD11 ' B' ' 305' ' ' LEU . 9.2 m-20 -144.59 79.21 12.59 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.677 0.751 . . . . 54.200000000000003 110.915 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 -5.83 17.19 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.617 2.211 . . . . 61.25 112.326 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.0 t -93.24 27.43 2.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 74.239999999999995 111.145 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.428 HD11 ' HB2' ' B' ' 302' ' ' ASP . 29.2 mt -101.31 136.83 40.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.235 -0.439 . . . . 75.150000000000006 110.981 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.638 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.2 t -105.95 172.81 6.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 75.140000000000001 111.118 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -49.43 -37.34 25.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 63.310000000000002 110.924 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -60.75 -52.43 65.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 74.140000000000001 110.85 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.638 ' HG2' HG22 ' B' ' 306' ' ' THR . 10.0 mm-40 -63.64 -52.39 60.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.475 . . . . 70.120000000000005 110.915 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.637 HD12 ' CG ' ' A' ' 111' ' ' ASN . 43.3 mm -55.83 -53.77 34.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 73.299999999999997 111.171 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 7.8 t -58.67 -22.84 58.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 72.109999999999999 110.855 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.54 4.28 25.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 64.420000000000002 111.054 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 313' ' ' MET . . . . . 0.626 ' HE2' HD13 ' B' ' 310' ' ' ILE . 1.4 mtm -113.88 8.86 17.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 70.409999999999997 110.894 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.513 ' HE2' HG22 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 21.2 p -109.07 -37.12 5.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.113 -1.403 . . . . 70.049999999999997 110.829 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 66.65 130.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 73.439999999999998 110.853 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.616 HG21 ' HB3' ' A' ' 141' ' ' ASP . 6.0 m -50.22 133.51 10.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 65.129999999999995 111.112 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.49 74.48 1.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 71.140000000000001 110.892 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.8 mttp -68.5 153.74 95.32 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.627 0.727 . . . . 74.540000000000006 110.911 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 114.12 3.6 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.721 2.28 . . . . 71.519999999999996 112.334 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 CA-C-O 119.102 -0.832 . . . . 72.319999999999993 112.505 -179.99 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 CA-C-O 121.444 0.469 . . . . 41.229999999999997 112.517 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 99.33 0.74 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.713 2.275 . . . . 74.200000000000003 112.339 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.412 HD22 ' CE ' ' A' ' 80' ' ' MET . 0.2 OUTLIER 69.04 -74.95 0.07 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 72.209999999999994 110.863 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 173.05 -41.72 0.16 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.714 -0.755 . . . . 70.420000000000002 112.527 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 69.1 p -130.83 56.25 1.8 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.867 0.365 . . . . 73.420000000000002 110.881 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.412 ' CE ' HD22 ' A' ' 77' ' ' LEU . 4.7 mtt -129.61 74.2 80.98 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.529 0.68 . . . . 73.409999999999997 110.832 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -7.0 19.96 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.693 2.262 . . . . 65.109999999999999 112.283 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.448 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 32.4 p-90 -101.51 -30.73 11.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.439 . . . . 74.439999999999998 110.888 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -89.91 108.1 19.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.419 . . . . 71.430000000000007 110.936 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 17.8 m80 -83.44 -46.97 11.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 50.119999999999997 110.891 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.89 33.0 71.57 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.707 -0.759 . . . . 54.299999999999997 112.538 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.61 33.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.712 0.292 . . . . 65.200000000000003 110.922 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.4 HG21 ' HB2' ' A' ' 92' ' ' ALA . 7.4 mm -103.3 144.07 14.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.420000000000002 111.072 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.19 159.35 16.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.125 -0.488 . . . . 73.120000000000005 111.213 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -54.14 -37.94 64.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 74.329999999999998 110.904 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -77.15 -32.05 56.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.232 -0.44 . . . . 73.030000000000001 110.829 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -70.09 -39.49 75.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 72.030000000000001 110.915 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.472 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -74.99 -35.99 62.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 70.5 111.151 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -58.87 -52.85 63.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 34.210000000000001 110.927 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.75 -35.63 80.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.495 . . . . 72.200000000000003 110.862 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 92' ' ' ALA . 11.5 mt -54.9 -38.49 67.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 74.540000000000006 110.926 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.701 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -98.46 43.67 1.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 64.019999999999996 110.949 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.503 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.72 -59.92 6.15 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.622 0.725 . . . . 75.340000000000003 110.912 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.9 Cg_endo -69.68 123.35 10.04 Favored 'Trans proline' 0 N--CA 1.465 -0.195 0 C-N-CA 122.73 2.287 . . . . 73.040000000000006 112.347 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 117.67 5.22 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.68 2.254 . . . . 75.310000000000002 112.333 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.9 105.29 2.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.217 -0.447 . . . . 73.400000000000006 110.862 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.691 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.0 OUTLIER -58.64 111.9 1.42 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.127 -0.488 . . . . 63.140000000000001 111.11 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.32 -5.09 6.32 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.718 -0.753 . . . . 64.109999999999999 112.511 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.31 117.49 29.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.876 0.37 . . . . 74.230000000000004 110.924 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.503 ' HB3' HD22 ' A' ' 167' ' ' LEU . 23.9 p90 -128.5 166.79 18.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.164 -0.471 . . . . 72.310000000000002 110.885 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.651 HD23 HD21 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -164.23 138.72 5.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 74.409999999999997 110.874 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.448 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 92.9 t -109.92 131.19 61.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 71.120000000000005 111.211 179.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.26 145.71 41.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 71.200000000000003 110.879 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.76 123.92 8.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 74.140000000000001 110.893 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.5 m -62.16 109.3 1.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 51.420000000000002 110.856 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.584 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.5 m -68.69 -56.31 8.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 73.329999999999998 111.167 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.54 ' CG ' HD12 ' B' ' 310' ' ' ILE . 67.2 m-80 -64.38 -27.04 68.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.196 -0.457 . . . . 65.120000000000005 110.823 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.413 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 2.4 m-85 -118.43 95.73 49.03 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.677 0.751 . . . . 65.200000000000003 110.869 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.6 Cg_endo -69.77 114.34 3.67 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.638 2.225 . . . . 61.240000000000002 112.368 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.41 -1.18 25.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.729 -0.748 . . . . 72.0 112.532 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -123.47 -172.97 2.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.789 0.328 . . . . 72.510000000000005 110.832 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -139.98 145.12 37.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 73.120000000000005 110.904 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.4 m -113.6 141.63 46.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 63.399999999999999 111.136 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.529 ' CD2' HD11 ' A' ' 163' ' ' LEU . 0.4 OUTLIER -113.14 118.97 36.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.244 -0.434 . . . . 44.399999999999999 110.913 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 14.7 t -102.66 129.94 49.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.445 . . . . 73.239999999999995 110.85 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.419 HG21 HD12 ' A' ' 163' ' ' LEU . 11.7 t -128.53 150.01 33.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.030000000000001 111.092 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.701 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.12 112.45 25.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 74.409999999999997 110.895 -179.828 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.13 91.46 3.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.116 -0.493 . . . . 62.140000000000001 110.862 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 66.35 32.21 7.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 73.0 110.896 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.34 -13.76 64.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.712 -0.756 . . . . 54.140000000000001 112.476 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.03 145.69 25.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.833 0.349 . . . . 70.319999999999993 110.909 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.485 ' O ' HD13 ' B' ' 294' ' ' LEU . 6.8 m -106.08 116.38 49.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 63.420000000000002 111.166 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -107.28 122.8 47.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 74.530000000000001 110.822 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -99.78 124.16 44.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 62.32 110.804 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.635 ' CE1' HD13 ' A' ' 163' ' ' LEU . 56.4 m-85 -110.8 116.99 32.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 54.140000000000001 110.881 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 129.73 40.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 75.549999999999997 110.78 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.497 HG12 HD11 ' A' ' 140' ' ' ILE . 33.3 mt -113.66 109.41 28.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 45.329999999999998 111.153 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -81.41 125.22 30.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 31.23 110.913 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.46 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.97 101.06 8.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.261 -0.427 . . . . 73.530000000000001 110.907 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -137.36 142.55 41.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 74.109999999999999 110.894 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.66 35.87 24.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 73.540000000000006 111.158 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 2.7 t 60.26 31.87 20.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 62.439999999999998 110.795 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mtmm -137.92 142.56 40.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.174 -0.466 . . . . 74.319999999999993 110.884 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.46 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 4.4 mp -105.64 152.2 23.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 70.409999999999997 110.929 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -169.59 139.94 2.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.449 . . . . 73.450000000000003 110.816 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.524 ' CG2' HG13 ' B' ' 317' ' ' VAL . 58.4 mt -115.65 -37.14 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 74.329999999999998 111.145 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.65 ' HB3' HG21 ' B' ' 317' ' ' VAL . 23.6 p30 -89.19 -5.26 57.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 75.129999999999995 110.915 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 61.98 15.87 7.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 62.140000000000001 110.901 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -123.79 -9.19 7.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.074 -0.512 . . . . 74.239999999999995 110.896 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.5 t -143.48 104.53 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.101 -0.5 . . . . 62.520000000000003 111.073 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -94.99 145.47 24.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 53.119999999999997 110.89 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.432 ' CD1' HD12 ' A' ' 152' ' ' LEU . 49.3 m-85 -117.09 178.05 4.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 73.319999999999993 110.869 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.68 -15.69 17.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 64.540000000000006 110.92 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.429 ' C ' HD13 ' A' ' 138' ' ' LEU . 1.5 t30 -165.76 172.07 12.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 71.329999999999998 110.849 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.5 -23.26 58.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 62.219999999999999 110.894 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.5 ttp -62.55 -57.19 12.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 63.420000000000002 110.864 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -65.73 -35.66 81.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.456 . . . . 71.109999999999999 110.97 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.432 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.54 -48.46 74.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.466 . . . . 64.310000000000002 110.958 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.77 HG13 HD12 ' A' ' 167' ' ' LEU . 71.0 t -64.79 -38.01 81.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.489 . . . . 75.120000000000005 111.124 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -55.4 -38.32 68.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 73.420000000000002 110.904 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -72.22 -45.2 61.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.430000000000007 110.826 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.526 ' CD1' HD23 ' A' ' 163' ' ' LEU . 32.5 m-85 -69.92 -15.82 63.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 75.099999999999994 110.968 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.421 HG23 ' O ' ' A' ' 167' ' ' LEU . 96.8 m -86.96 -34.16 19.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.079 -0.509 . . . . 74.319999999999993 111.128 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.5 t -80.09 -23.45 41.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 60.039999999999999 111.164 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.25 153.65 24.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 64.120000000000005 110.855 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.51 -58.16 7.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 41.530000000000001 111.116 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 56.21 25.19 8.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 55.200000000000003 110.928 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 119.28 -11.3 11.5 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.742 -0.742 . . . . 71.420000000000002 112.483 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.635 HD13 ' CE1' ' A' ' 129' ' ' TYR . 3.8 mm? -86.93 138.38 31.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.896 0.379 . . . . 70.319999999999993 110.894 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 19.5 t -51.23 -29.51 14.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.141 -0.481 . . . . 72.019999999999996 110.856 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.467 HG21 HG22 ' A' ' 101' ' ' THR . 4.5 t -158.99 128.13 5.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 72.400000000000006 111.095 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -51.62 139.53 20.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 73.209999999999994 110.928 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.77 HD12 HG13 ' A' ' 153' ' ' VAL . 8.5 mt -60.95 139.54 58.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.258 -0.428 . . . . 65.239999999999995 110.874 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.691 HD12 ' O ' ' A' ' 101' ' ' THR . 26.4 mt -127.13 -51.5 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 53.509999999999998 111.148 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -128.15 122.04 21.94 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.578 0.704 . . . . 72.219999999999999 110.932 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 138.45 37.99 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.753 2.302 . . . . 72.519999999999996 112.329 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.42 84.03 0.4 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 61.420000000000002 110.899 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 28.7 m -64.38 138.52 22.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.438 . . . . 71.519999999999996 111.174 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.1 ptm . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 75.450000000000003 110.844 179.992 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 CA-C-O 121.431 0.462 . . . . 65.010000000000005 112.445 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 169.88 17.9 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 73.519999999999996 112.321 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 10.4 mp -56.74 -41.6 77.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 73.420000000000002 110.87 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 73.37 30.57 62.33 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.779 -0.724 . . . . 71.109999999999999 112.471 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 5.8 t -78.29 73.5 4.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.962 0.41 . . . . 71.010000000000005 110.901 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 38.1 tttt -158.54 129.0 6.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.109 -0.496 . . . . 63.539999999999999 110.899 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -173.18 176.36 2.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 62.530000000000001 110.856 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -174.41 66.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 73.349999999999994 110.847 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 53.8 p -176.93 121.55 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 74.540000000000006 110.842 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.75 108.63 0.79 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.145 -0.479 . . . . 71.200000000000003 110.86 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.485 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER -163.92 102.34 0.89 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.473 . . . . 65.519999999999996 110.899 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 4.4 p -96.72 88.88 4.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 61.240000000000002 110.859 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -77.0 145.64 37.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.11 -0.495 . . . . 73.549999999999997 110.962 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -136.7 129.58 30.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 63.340000000000003 110.888 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 298' ' ' SER . . . . . 0.584 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -91.82 164.31 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.276 -0.42 . . . . 62.5 110.853 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 28.6 mtt180 -67.78 -12.47 60.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 61.420000000000002 110.889 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.23 -37.84 66.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 71.540000000000006 110.889 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -95.93 -16.84 21.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.139 -0.482 . . . . 73.230000000000004 110.904 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.531 ' HB2' HD11 ' B' ' 305' ' ' LEU . 31.5 m-20 -153.73 79.08 5.39 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.646 0.736 . . . . 70.200000000000003 110.912 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 -6.57 18.88 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.709 2.272 . . . . 60.039999999999999 112.33 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 15.3 t -93.78 27.24 2.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 43.439999999999998 111.113 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' B' ' 302' ' ' ASP . 44.5 mt -101.31 136.79 40.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.202 -0.454 . . . . 62.32 110.985 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.59 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.0 t -103.17 169.99 8.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 52.530000000000001 111.103 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -49.66 -32.5 13.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.209999999999994 110.856 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -63.98 -47.64 79.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 60.229999999999997 110.875 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.59 ' HG2' HG22 ' B' ' 306' ' ' THR . 3.4 mm-40 -65.34 -49.27 70.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 54.140000000000001 110.879 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.54 HD12 ' CG ' ' A' ' 111' ' ' ASN . 24.3 mm -61.54 -53.24 51.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 65.109999999999999 111.202 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 79.3 p -58.57 -23.39 58.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 73.040000000000006 110.855 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -78.79 -1.63 35.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.479 . . . . 60.020000000000003 111.062 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -114.7 10.32 16.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 74.430000000000007 110.931 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 1.7 t -97.67 -33.7 11.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.091 -1.413 . . . . 63.119999999999997 110.808 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 5.8 t 65.12 151.69 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 73.049999999999997 110.838 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.65 HG21 ' HB3' ' A' ' 141' ' ' ASP . 6.8 m -59.02 120.32 4.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.093 -0.503 . . . . 71.040000000000006 111.14 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -127.34 74.85 1.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 71.030000000000001 110.918 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -63.82 160.59 44.42 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.654 0.74 . . . . 74.230000000000004 110.881 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.85 113.0 3.24 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.687 2.258 . . . . 64.310000000000002 112.333 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.37 0 CA-C-O 119.132 -0.816 . . . . 63.520000000000003 112.517 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 121.417 0.454 . . . . 74.319999999999993 112.505 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -44.15 2.25 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.674 2.249 . . . . 63.200000000000003 112.366 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.3 mp -108.56 -33.33 7.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.21 -0.45 . . . . 73.230000000000004 110.94 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 169.64 -46.03 0.21 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.748 -0.739 . . . . 62.310000000000002 112.454 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 12.9 p -166.21 54.89 0.1 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.897 0.38 . . . . 61.240000000000002 110.834 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 28.0 mtt -129.4 73.61 81.5 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.57 0.7 . . . . 61.25 110.883 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.77 -7.77 21.91 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.643 2.229 . . . . 71.109999999999999 112.379 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.469 ' CH2' HG21 ' A' ' 153' ' ' VAL . 37.0 p-90 -100.2 -25.99 14.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.465 . . . . 65.049999999999997 110.918 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -98.73 103.14 15.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.249 -0.432 . . . . 75.239999999999995 110.913 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -79.58 -45.43 19.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 65.109999999999999 110.938 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 60.82 35.31 89.88 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.699 -0.762 . . . . 60.020000000000003 112.497 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.3 34.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.743 0.306 . . . . 73.510000000000005 110.885 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.605 HG23 ' HB3' ' A' ' 91' ' ' GLN . 16.7 mm -109.19 144.96 16.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 72.209999999999994 111.133 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -97.76 177.5 5.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 72.219999999999999 111.141 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ppt_? -65.35 -40.7 93.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 65.239999999999995 110.872 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -38.06 89.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 65.200000000000003 110.889 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.605 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -76.11 -37.7 57.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 72.140000000000001 110.93 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.61 -36.26 78.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 111.089 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -67.83 -53.06 29.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.158 -0.474 . . . . 71.340000000000003 110.913 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.09 -35.0 79.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 72.420000000000002 110.82 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.17 -36.02 82.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 70.530000000000001 110.94 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.588 HD12 ' CB ' ' A' ' 121' ' ' SER . 2.6 mm? -103.19 43.44 1.08 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.18 -0.464 . . . . 71.409999999999997 110.951 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.494 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.27 -60.12 4.41 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.776 0.798 . . . . 73.420000000000002 110.914 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.74 123.32 9.99 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.627 2.218 . . . . 72.540000000000006 112.388 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.78 118.14 5.5 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.72 2.28 . . . . 63.340000000000003 112.297 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -155.01 111.08 3.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 73.010000000000005 110.884 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.631 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -63.16 112.69 2.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.068 -0.515 . . . . 65.319999999999993 111.154 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.97 -6.94 6.43 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.809 -0.71 . . . . 61.009999999999998 112.556 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.458 HD12 ' O ' ' A' ' 169' ' ' LYS . 2.4 tp -90.26 114.6 26.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.842 0.353 . . . . 75.030000000000001 110.835 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.667 ' HB3' HD22 ' A' ' 167' ' ' LEU . 20.2 p90 -126.24 164.34 21.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 74.329999999999998 110.927 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.586 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -161.24 136.45 7.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 63.130000000000003 110.928 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.432 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 86.2 t -110.19 132.84 57.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 72.340000000000003 111.161 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -142.3 149.96 40.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 73.120000000000005 110.846 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.22 124.05 15.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 72.530000000000001 110.911 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.8 m -60.02 112.6 1.94 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 61.240000000000002 110.857 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.9 m -68.68 -53.29 23.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 75.409999999999997 111.161 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.418 ' CG ' HD12 ' B' ' 310' ' ' ILE . 6.6 m-80 -63.86 -29.45 70.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 54.200000000000003 110.9 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -123.45 97.4 42.45 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.648 0.737 . . . . 72.150000000000006 110.983 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.68 123.85 10.54 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.654 2.236 . . . . 73.219999999999999 112.398 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.61 -14.99 22.26 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.763 -0.732 . . . . 74.430000000000007 112.453 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -116.15 -175.34 2.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.777 0.322 . . . . 62.439999999999998 110.809 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -135.92 156.63 48.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 71.150000000000006 110.95 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 92.3 m -128.05 131.06 49.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 54.140000000000001 111.173 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.01 124.36 43.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.288 -0.415 . . . . 72.409999999999997 110.988 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.9 t -108.44 125.79 52.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 64.049999999999997 110.89 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.1 t -124.86 151.57 30.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.239999999999995 111.195 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.588 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -101.9 111.24 23.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 74.140000000000001 110.818 -179.834 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.28 89.73 3.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 52.229999999999997 110.93 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 67.97 31.71 5.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 71.329999999999998 110.799 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.94 -14.48 62.71 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.738 -0.744 . . . . 74.319999999999993 112.515 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -88.09 139.79 30.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.839 0.352 . . . . 73.329999999999998 110.941 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.475 HG23 ' HB3' ' B' ' 294' ' ' LEU . 7.3 m -100.44 106.74 19.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 75.239999999999995 111.085 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -95.77 121.31 37.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 62.509999999999998 110.949 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -100.75 124.88 47.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 73.510000000000005 110.848 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -112.66 120.24 40.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.169 -0.469 . . . . 73.340000000000003 110.882 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -67.86 133.11 48.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.1 -0.5 . . . . 75.030000000000001 110.91 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 49.7 mt -117.34 107.63 22.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 73.319999999999993 111.129 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.6 ttm -83.01 123.34 29.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 74.25 110.888 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.467 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.07 100.8 8.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.312 -0.404 . . . . 73.109999999999999 110.949 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -136.36 142.5 43.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 75.400000000000006 110.801 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.17 35.99 25.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 75.519999999999996 111.114 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.4 t 60.33 29.76 19.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.239 -0.437 . . . . 72.099999999999994 110.811 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -136.31 140.99 43.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 74.140000000000001 110.873 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.581 HD21 ' HG ' ' A' ' 149' ' ' LEU . 5.0 mp -101.93 153.72 19.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 64.030000000000001 110.915 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.59 139.21 2.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.48 . . . . 71.209999999999994 110.863 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.449 HD12 ' CZ ' ' A' ' 156' ' ' TYR . 50.1 mt -115.5 -28.9 2.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 71.010000000000005 111.108 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -101.14 -5.32 25.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.161 -0.472 . . . . 71.030000000000001 110.873 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 63.63 14.62 8.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 70.319999999999993 110.835 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -119.42 -19.74 8.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.446 . . . . 74.030000000000001 110.918 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -133.7 104.3 6.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.108 -0.497 . . . . 64.530000000000001 111.128 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -94.04 144.87 25.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.218 -0.447 . . . . 75.239999999999995 110.9 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -113.04 175.08 5.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.124 -0.489 . . . . 73.109999999999999 110.874 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -96.02 -16.91 21.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.141 -0.481 . . . . 61.340000000000003 110.861 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -173.77 158.82 3.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 52.299999999999997 110.893 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.581 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.9 OUTLIER -51.5 -36.31 44.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 74.329999999999998 110.935 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.9 ttp -52.29 -51.39 58.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 52.5 110.902 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.0 -39.63 90.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 75.450000000000003 110.944 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.67 -53.41 56.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 74.140000000000001 110.907 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.509 HG13 HD12 ' A' ' 167' ' ' LEU . 69.4 t -61.5 -36.7 74.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 74.109999999999999 111.118 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -54.99 -40.27 69.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 74.030000000000001 110.903 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.21 -52.3 17.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 73.140000000000001 110.891 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.676 ' CD1' HD13 ' A' ' 163' ' ' LEU . 63.1 m-85 -62.72 -17.15 60.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 74.340000000000003 110.94 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.3 m -87.44 -32.79 19.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.085 -0.507 . . . . 63.030000000000001 111.126 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 19.3 m -77.46 -21.56 52.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.254 -0.43 . . . . 72.230000000000004 111.182 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.74 176.35 4.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 74.319999999999993 110.832 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.88 -58.13 6.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 65.140000000000001 111.111 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.81 19.68 8.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 72.150000000000006 110.855 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 162' ' ' GLY . . . . . 0.846 ' HA3' HG23 ' B' ' 317' ' ' VAL . . . 116.66 -8.45 17.14 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.742 -0.742 . . . . 64.409999999999997 112.423 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.676 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.1 mp -94.5 148.06 22.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.863 0.363 . . . . 75.230000000000004 110.869 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 22.1 p -54.35 -27.25 34.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 75.319999999999993 110.983 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.504 HG21 HG22 ' A' ' 101' ' ' THR . 14.7 t -159.55 133.74 7.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.126 -0.488 . . . . 62.549999999999997 111.101 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.3 ptt-85 -53.93 173.14 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 72.329999999999998 110.91 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.667 HD22 ' HB3' ' A' ' 104' ' ' PHE . 15.0 mt -93.82 141.73 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 71.510000000000005 110.895 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.631 HD12 ' O ' ' A' ' 101' ' ' THR . 30.4 mt -125.41 -51.19 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.194 -0.457 . . . . 64.230000000000004 111.213 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 169' ' ' LYS . . . . . 0.458 ' O ' HD12 ' A' ' 103' ' ' LEU . 8.3 mmtt -128.81 122.4 21.47 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.563 0.697 . . . . 73.310000000000002 110.886 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 138.41 37.56 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.635 2.223 . . . . 73.230000000000004 112.352 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.81 84.55 0.31 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 63.130000000000003 110.899 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.1 m -64.32 135.28 28.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 74.230000000000004 111.1 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.5 mtm . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 65.010000000000005 110.847 179.87 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 CA-C-O 121.466 0.481 . . . . 53.32 112.5 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.86 163.92 36.55 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.704 2.269 . . . . 70.409999999999997 112.335 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 36.5 mt -52.66 -32.48 42.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.26 -0.427 . . . . 50.119999999999997 110.865 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 111.44 -31.95 6.79 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.775 -0.726 . . . . 74.109999999999999 112.537 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 4.5 m -88.32 94.56 9.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.996 0.427 . . . . 64.450000000000003 110.871 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.13 140.01 18.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 71.299999999999997 110.887 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -179.87 92.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 74.209999999999994 110.895 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 5.3 t80 179.06 106.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 75.540000000000006 110.867 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 46.0 t -90.61 105.34 17.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 74.040000000000006 110.891 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -171.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.185 -0.461 . . . . 60.32 110.814 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.475 ' HB3' HG23 ' A' ' 126' ' ' VAL . 0.0 OUTLIER -153.18 104.53 2.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 73.409999999999997 110.896 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -91.64 88.56 6.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 53.100000000000001 110.883 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -77.91 126.78 31.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 72.239999999999995 110.912 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -123.77 128.26 49.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.094 -0.503 . . . . 62.210000000000001 110.879 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 5.8 m -88.99 165.24 14.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 74.439999999999998 110.92 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -59.53 -19.16 46.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 53.219999999999999 110.886 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -37.01 82.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 74.129999999999995 110.887 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -104.28 -21.1 13.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 64.510000000000005 110.854 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.49 ' HB2' HD11 ' B' ' 305' ' ' LEU . 3.6 m-20 -141.57 77.22 19.63 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.618 0.723 . . . . 74.140000000000001 110.813 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -6.76 19.37 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.732 2.288 . . . . 75.319999999999993 112.328 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 10.4 t -93.79 27.45 2.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.192 -0.458 . . . . 63.039999999999999 111.152 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' B' ' 302' ' ' ASP . 48.3 mt -100.84 136.96 39.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.192 -0.458 . . . . 75.319999999999993 110.89 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.592 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.6 t -108.84 174.35 5.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 75.129999999999995 111.183 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -50.26 -35.37 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.254 -0.43 . . . . 71.129999999999995 110.847 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 308' ' ' GLU . . . . . 0.42 ' H ' HG23 ' B' ' 306' ' ' THR . 1.2 tm-20 -63.16 -46.88 85.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.131 -0.486 . . . . 73.219999999999999 110.935 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.592 ' HG2' HG22 ' B' ' 306' ' ' THR . 11.6 mm-40 -68.4 -47.58 66.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.137 -0.483 . . . . 72.329999999999998 110.889 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.6 HG23 ' O3P' ' B' ' 314' ' ' PTR . 44.2 mm -56.03 -45.41 80.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 75.219999999999999 111.124 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 59.0 p -76.67 -15.86 59.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 70.150000000000006 110.859 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -74.92 -17.27 60.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.499 . . . . 62.509999999999998 111.066 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.5 ptp -109.8 15.17 22.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 32.109999999999999 110.875 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.6 ' O3P' HG23 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 13.7 t -77.7 -39.56 44.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.071 -1.422 . . . . 62.350000000000001 110.808 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.1 p 67.28 131.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 73.349999999999994 110.894 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.846 HG23 ' HA3' ' A' ' 162' ' ' GLY . 2.1 p -48.59 130.88 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.131 -0.486 . . . . 63.219999999999999 111.112 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -146.72 74.65 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 64.239999999999995 110.868 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.7 mttt -58.94 160.61 10.62 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.582 0.706 . . . . 74.239999999999995 110.847 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 112.06 2.98 Favored 'Trans proline' 0 C--N 1.34 0.129 0 C-N-CA 122.727 2.285 . . . . 51.149999999999999 112.37 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.684 -0.77 . . . . 50.0 112.511 -179.966 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 CA-C-O 121.414 0.452 . . . . 44.340000000000003 112.507 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 -46.33 1.23 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.63 2.22 . . . . 55.240000000000002 112.339 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.63 -30.82 8.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 64.310000000000002 110.932 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -179.57 -59.97 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.746 -0.74 . . . . 32.32 112.472 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 73.1 m -161.62 63.07 0.26 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.819 0.343 . . . . 64.530000000000001 110.837 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -134.15 73.9 68.96 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.58 0.705 . . . . 72.420000000000002 110.892 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -7.97 22.4 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.69 2.26 . . . . 73.099999999999994 112.319 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.406 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 41.5 p-90 -102.18 -26.15 13.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.23 -0.441 . . . . 74.430000000000007 110.893 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -96.01 99.7 11.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 75.129999999999995 110.857 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.8 m-70 -75.63 -36.68 60.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 65.019999999999996 110.926 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.71 27.36 58.83 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.703 -0.761 . . . . 61.350000000000001 112.52 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.46 63.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.83 0.348 . . . . 74.409999999999997 110.973 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 15.3 mm -126.76 144.0 38.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.468 . . . . 62.219999999999999 111.13 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.466 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -93.93 171.83 8.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.209999999999994 111.173 179.906 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.466 ' H ' HG22 ' A' ' 88' ' ' THR . 6.6 ppt_? -63.32 -38.24 90.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 74.420000000000002 110.839 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -76.63 -30.84 57.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 73.439999999999998 110.991 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -70.9 -43.28 68.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.099 -0.501 . . . . 74.030000000000001 110.957 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.472 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -72.72 -37.26 67.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 74.439999999999998 111.152 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.79 -53.1 62.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 71.420000000000002 110.906 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -33.91 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 71.329999999999998 110.841 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 92' ' ' ALA . 9.8 mt -54.69 -38.23 66.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 52.329999999999998 110.925 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.662 HD21 HD23 ' A' ' 105' ' ' LEU . 3.7 mm? -100.33 43.5 1.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.22 -0.446 . . . . 73.209999999999994 110.92 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.501 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -64.32 -59.94 9.75 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.678 0.751 . . . . 74.099999999999994 110.941 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.4 Cg_endo -69.68 123.15 9.84 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.64 2.227 . . . . 61.240000000000002 112.394 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.67 116.56 4.61 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 122.667 2.245 . . . . 74.219999999999999 112.37 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -154.99 108.76 2.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.43 . . . . 61.210000000000001 110.901 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.0 OUTLIER -61.61 111.93 2.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 62.200000000000003 111.15 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.66 -6.82 6.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.731 -0.747 . . . . 64.420000000000002 112.511 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 tp -89.73 111.95 23.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.836 0.351 . . . . 71.439999999999998 110.899 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.406 ' CD2' HD13 ' A' ' 167' ' ' LEU . 23.7 p90 -124.05 167.94 13.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 74.450000000000003 110.878 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.662 HD23 HD21 ' A' ' 96' ' ' LEU . 0.9 OUTLIER -164.67 135.22 4.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 74.409999999999997 110.915 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.406 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 88.6 t -110.25 138.35 38.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.472 . . . . 72.109999999999999 111.074 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -150.66 154.32 37.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.096 -0.502 . . . . 74.319999999999993 110.851 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -51.85 124.39 12.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 63.539999999999999 110.92 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.9 m -63.84 113.39 3.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.226 -0.443 . . . . 73.129999999999995 110.861 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.6 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.1 m -68.9 -56.35 8.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.109 -0.496 . . . . 65.209999999999994 111.173 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.603 ' CG ' HD12 ' B' ' 310' ' ' ILE . 23.2 m-80 -68.67 -23.86 64.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 64.439999999999998 110.942 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -115.42 94.77 40.88 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.693 0.759 . . . . 74.150000000000006 111.004 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 109.94 2.43 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.659 2.24 . . . . 73.129999999999995 112.372 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.43 3.49 24.04 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.723 -0.751 . . . . 72.239999999999995 112.536 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -129.4 -175.84 3.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.819 0.342 . . . . 71.0 110.92 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -135.93 144.87 45.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 74.209999999999994 110.948 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.7 m -108.58 141.59 40.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 71.439999999999998 111.144 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.529 ' CD2' HD11 ' A' ' 163' ' ' LEU . 0.4 OUTLIER -114.79 107.98 16.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 71.129999999999995 110.891 179.989 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 119' ' ' CYS . . . . . 0.564 ' SG ' HG13 ' A' ' 126' ' ' VAL . 10.5 t -93.07 134.9 34.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 61.340000000000003 110.878 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.0 t -138.07 148.35 25.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 63.420000000000002 111.126 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.653 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -100.51 111.64 23.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 61.509999999999998 110.905 -179.869 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -113.86 91.49 3.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.142 -0.481 . . . . 71.120000000000005 110.856 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 66.38 31.55 8.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 74.239999999999995 110.913 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.98 -13.28 63.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.741 -0.742 . . . . 52.43 112.544 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -87.96 140.0 29.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.799 0.333 . . . . 72.150000000000006 110.887 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.564 HG13 ' SG ' ' A' ' 119' ' ' CYS . 57.7 t -98.77 108.15 21.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 75.420000000000002 111.13 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -101.67 128.52 47.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 74.439999999999998 110.909 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 -105.41 125.04 50.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 75.340000000000003 110.874 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.615 ' CE1' HD13 ' A' ' 163' ' ' LEU . 49.3 m-85 -112.71 116.72 30.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.469 . . . . 60.229999999999997 110.909 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.22 137.19 44.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.125 -0.489 . . . . 72.310000000000002 110.811 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.451 HG12 HD11 ' A' ' 140' ' ' ILE . 39.8 mt -118.17 109.59 27.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 72.329999999999998 111.093 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.85 124.19 28.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 71.5 110.94 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.482 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -113.39 98.19 6.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.24 -0.436 . . . . 71.140000000000001 110.917 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -131.51 142.6 49.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.051 -0.522 . . . . 72.310000000000002 110.862 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.98 35.97 26.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.222 -0.445 . . . . 63.310000000000002 111.107 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 61.08 30.24 19.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 63.030000000000001 110.906 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -134.82 141.09 46.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.094 -0.503 . . . . 72.299999999999997 110.917 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.532 HD21 ' HG ' ' A' ' 149' ' ' LEU . 4.9 mp -102.39 149.52 24.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.442 . . . . 74.219999999999999 110.892 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 14.0 t -166.9 137.8 3.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 63.350000000000001 110.861 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.645 HG22 HG13 ' B' ' 317' ' ' VAL . 53.2 mt -115.7 -32.16 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.51 . . . . 73.409999999999997 111.16 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.572 ' CB ' HG21 ' B' ' 317' ' ' VAL . 49.3 t0 -97.39 10.6 39.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 71.230000000000004 110.89 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 9.7 pt-20 45.96 29.89 0.82 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.157 -0.474 . . . . 71.409999999999997 110.888 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -132.51 -40.08 1.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 73.420000000000002 110.867 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.445 ' O ' HG13 ' A' ' 144' ' ' VAL . 2.7 p -116.28 104.62 16.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 73.239999999999995 111.11 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -93.41 150.75 20.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 72.310000000000002 110.952 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.474 ' CD1' HD12 ' A' ' 152' ' ' LEU . 44.8 m-85 -121.08 178.2 4.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.193 -0.458 . . . . 74.219999999999999 110.896 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -100.37 -16.08 17.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 75.25 110.891 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.476 ' C ' HD13 ' A' ' 138' ' ' LEU . 1.2 t30 -164.88 172.5 12.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 64.340000000000003 110.853 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.532 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.5 OUTLIER -74.6 -27.55 60.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 70.319999999999993 110.893 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.7 -57.21 14.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 61.100000000000001 110.85 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -66.04 -36.36 83.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 63.32 110.951 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.474 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.63 -49.52 72.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.208 -0.451 . . . . 75.310000000000002 110.926 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.616 HG13 HD12 ' A' ' 167' ' ' LEU . 71.3 t -63.42 -38.36 81.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 75.409999999999997 111.121 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.99 -39.35 68.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 73.140000000000001 110.844 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -71.42 -44.55 64.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 74.239999999999995 110.817 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -68.26 -20.81 64.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 64.239999999999995 110.925 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 67.2 m -84.66 -30.39 24.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 53.340000000000003 111.161 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 13.2 m -79.68 -25.12 41.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.268 -0.424 . . . . 64.349999999999994 111.123 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -162.27 155.48 20.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 74.510000000000005 110.898 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.455 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -51.35 -58.4 6.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 73.400000000000006 111.089 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 51.77 29.81 6.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 73.540000000000006 110.876 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 120.57 -14.7 9.92 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.735 -0.745 . . . . 62.140000000000001 112.462 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.615 HD13 ' CE1' ' A' ' 129' ' ' TYR . 4.0 mm? -88.13 136.9 32.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.915 0.388 . . . . 74.340000000000003 110.939 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 164' ' ' CYS . . . . . 0.424 ' SG ' HG22 ' A' ' 165' ' ' THR . 19.3 p -53.86 -26.46 24.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 53.310000000000002 110.851 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.424 HG22 ' SG ' ' A' ' 164' ' ' CYS . 10.2 t -157.58 127.55 6.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 72.0 111.151 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -54.98 140.44 37.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 75.349999999999994 110.841 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.616 HD12 HG13 ' A' ' 153' ' ' VAL . 8.1 mt -60.31 141.44 56.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.464 . . . . 71.340000000000003 110.901 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 101' ' ' THR . 24.2 mt -126.97 -51.41 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 63.240000000000002 111.081 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -131.68 124.27 19.8 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.538 0.685 . . . . 75.0 110.922 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.89 136.65 33.17 Favored 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.664 2.243 . . . . 73.519999999999996 112.296 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.73 85.0 0.31 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 61.210000000000001 110.89 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 25.2 m -64.12 133.17 29.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 73.319999999999993 111.118 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 28.4 mtp . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 60.32 110.911 179.921 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 CA-C-O 121.429 0.461 . . . . 74.549999999999997 112.485 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 165.91 29.34 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.627 2.218 . . . . 70.129999999999995 112.384 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 3.2 mp -58.42 -33.95 70.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.184 -0.462 . . . . 71.120000000000005 110.974 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 92.03 30.71 9.89 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.768 -0.73 . . . . 64.530000000000001 112.482 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 75.2 m -78.69 156.03 29.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.952 0.406 . . . . 75.219999999999999 110.938 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -101.32 161.08 13.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 71.209999999999994 110.94 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -172.71 163.55 5.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.419 . . . . 74.349999999999994 110.859 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -167.76 62.8 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 74.349999999999994 110.814 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 18.6 p -179.41 139.76 0.15 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.155 -0.475 . . . . 65.340000000000003 110.833 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 2.2 t -178.63 105.36 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 75.129999999999995 110.922 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.454 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER -163.85 100.57 0.89 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 64.120000000000005 110.934 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.83 88.82 6.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 74.140000000000001 110.86 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -77.82 147.52 35.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 72.129999999999995 111.006 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.19 129.23 19.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 62.520000000000003 110.859 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 298' ' ' SER . . . . . 0.6 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -93.27 160.12 14.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 73.140000000000001 110.817 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 -61.82 -17.26 55.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 75.019999999999996 110.953 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -37.13 84.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 63.340000000000003 110.909 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -97.99 -19.17 18.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 62.329999999999998 110.915 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.528 ' HB2' HD11 ' B' ' 305' ' ' LEU . 34.4 m-20 -150.98 80.08 6.74 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.608 0.718 . . . . 75.299999999999997 110.872 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 -6.58 18.94 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.652 2.234 . . . . 72.25 112.348 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.7 t -94.06 27.45 2.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 73.329999999999998 111.049 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.528 HD11 ' HB2' ' B' ' 302' ' ' ASP . 46.2 mt -100.81 136.84 40.03 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.267 -0.424 . . . . 75.109999999999999 110.959 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.594 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.8 t -105.56 171.0 7.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 73.209999999999994 111.093 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -49.57 -35.42 20.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 61.310000000000002 110.848 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -61.38 -47.78 84.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.152 -0.476 . . . . 72.420000000000002 110.903 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.594 ' HG2' HG22 ' B' ' 306' ' ' THR . 9.7 mm-40 -67.97 -52.08 39.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 73.420000000000002 110.84 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.603 HD12 ' CG ' ' A' ' 111' ' ' ASN . 40.2 mm -56.65 -53.52 40.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 72.099999999999994 111.183 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 84.1 p -57.28 -29.85 64.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 52.229999999999997 110.789 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -69.91 -10.25 57.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 72.450000000000003 111.101 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -105.5 7.73 33.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 64.040000000000006 110.854 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 24.3 p -95.49 -33.22 12.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.174 -1.375 . . . . 53.329999999999998 110.873 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.11 151.61 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 71.430000000000007 110.884 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.645 HG13 HG22 ' A' ' 140' ' ' ILE . 5.7 m -55.89 122.89 5.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.17 -0.468 . . . . 75.510000000000005 111.143 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -131.34 74.63 1.6 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 60.109999999999999 110.846 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? -64.55 160.38 52.64 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.546 0.688 . . . . 74.310000000000002 110.886 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 111.3 2.76 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.646 2.231 . . . . 64.219999999999999 112.382 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 CA-C-O 119.093 -0.837 . . . . 64.439999999999998 112.485 -179.992 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 CA-C-O 121.415 0.453 . . . . 65.150000000000006 112.456 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -43.42 2.64 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.713 2.275 . . . . 61.310000000000002 112.316 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -107.31 -29.29 9.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.198 -0.455 . . . . 73.040000000000006 110.898 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 158.64 -58.86 0.33 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.749 -0.738 . . . . 35.049999999999997 112.491 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.2 t -159.29 43.2 0.23 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.856 0.36 . . . . 74.099999999999994 110.926 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -133.83 70.26 75.16 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.581 0.705 . . . . 74.530000000000001 110.882 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.76 -30.34 22.46 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.741 2.294 . . . . 71.340000000000003 112.382 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.474 ' CH2' HG21 ' A' ' 153' ' ' VAL . 50.1 p-90 -54.76 -26.67 35.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 73.239999999999995 110.893 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -88.0 100.65 13.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.295 -0.411 . . . . 74.129999999999995 110.888 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -75.68 -38.39 58.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.488 . . . . 72.230000000000004 110.883 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.68 18.84 40.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.799 -0.715 . . . . 73.120000000000005 112.473 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.72 81.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.775 0.322 . . . . 75.420000000000002 110.884 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.615 HG23 ' HB3' ' A' ' 91' ' ' GLN . 29.3 mm -147.1 145.16 19.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.245 -0.434 . . . . 74.420000000000002 111.145 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -97.82 177.29 5.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 65.140000000000001 111.132 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -38.86 89.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 61.43 110.905 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -37.68 88.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.246 -0.434 . . . . 72.540000000000006 110.973 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.615 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -76.35 -37.06 57.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.077 -0.511 . . . . 70.219999999999999 110.966 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.37 -33.79 65.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 71.129999999999995 111.132 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -67.74 -53.09 30.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 73.0 110.923 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.16 -39.26 94.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 73.439999999999998 110.853 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.504 HD22 ' HE2' ' A' ' 171' ' ' LYS . 15.1 mt -58.97 -37.57 77.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 72.120000000000005 110.942 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.649 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -100.88 43.07 1.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.442 . . . . 75.420000000000002 110.902 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.496 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -70.01 -59.92 3.98 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.668 0.747 . . . . 74.230000000000004 110.924 -179.978 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.0 Cg_endo -69.74 124.05 10.71 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.771 2.314 . . . . 74.109999999999999 112.309 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 117.32 5.01 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.648 2.232 . . . . 74.420000000000002 112.407 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -155.09 102.6 2.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 62.509999999999998 110.884 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.668 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.2 OUTLIER -56.03 111.51 0.96 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 71.340000000000003 111.142 -179.926 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 131.28 -10.5 5.59 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.755 -0.736 . . . . 60.520000000000003 112.47 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -86.71 111.64 20.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.823 0.344 . . . . 63.149999999999999 110.933 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.418 ' HB2' HD11 ' A' ' 118' ' ' LEU . 21.0 p90 -124.2 162.38 23.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 70.450000000000003 110.888 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.644 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -159.11 135.76 9.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 75.099999999999994 110.931 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 93.1 t -109.9 134.71 51.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.221 -0.445 . . . . 54.009999999999998 111.078 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 7.5 ptt85 -148.27 141.67 25.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.451 . . . . 74.140000000000001 110.941 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -51.29 128.65 22.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 52.329999999999998 110.906 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.23 116.87 3.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 74.310000000000002 110.861 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.511 HG21 ' HG2' ' B' ' 300' ' ' GLU . 9.8 m -70.23 -26.28 63.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 52.420000000000002 111.121 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -106.68 -0.91 23.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.2 -0.455 . . . . 71.340000000000003 110.946 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.415 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 0.6 OUTLIER -139.95 90.41 10.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.641 0.734 . . . . 70.310000000000002 110.969 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 54.2 Cg_endo -69.75 118.34 5.62 Favored 'Trans proline' 0 C--N 1.34 0.131 0 C-N-CA 122.648 2.232 . . . . 74.200000000000003 112.345 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 114.19 -14.68 21.03 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.777 -0.725 . . . . 65.209999999999994 112.533 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -120.14 158.84 26.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.783 0.325 . . . . 74.310000000000002 110.911 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -113.86 149.32 35.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 72.340000000000003 110.886 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.595 HG23 ' HE1' ' B' ' 314' ' ' PTR . 69.5 m -125.48 124.51 41.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 51.219999999999999 111.125 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.523 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.4 OUTLIER -96.38 134.39 39.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 70.109999999999999 110.957 179.924 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 48.8 t -116.94 127.06 53.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.455 . . . . 53.520000000000003 110.934 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.523 ' CG2' HD21 ' A' ' 118' ' ' LEU . 14.7 t -123.68 152.82 29.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.46 . . . . 70.420000000000002 111.097 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.649 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -104.39 112.13 25.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 52.420000000000002 110.883 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.76 95.7 5.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 60.539999999999999 110.915 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 67.68 28.55 7.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.465 . . . . 75.439999999999998 110.938 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.74 -14.39 63.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.746 -0.74 . . . . 45.140000000000001 112.51 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 142.45 27.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.37 . . . . 72.120000000000005 110.897 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.554 ' O ' HD13 ' B' ' 294' ' ' LEU . 12.1 m -100.57 114.28 38.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.476 . . . . 72.540000000000006 111.185 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -104.69 123.79 48.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 72.019999999999996 110.855 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -100.52 129.17 46.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.484 . . . . 51.229999999999997 110.873 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.425 ' HB3' HD13 ' A' ' 140' ' ' ILE . 62.3 m-85 -117.94 104.01 10.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.186 -0.461 . . . . 64.319999999999993 110.901 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.552 ' O ' HG23 ' A' ' 140' ' ' ILE . 0.1 OUTLIER -58.02 140.18 52.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 71.230000000000004 110.905 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.411 HG12 HD11 ' A' ' 140' ' ' ILE . 44.2 mt -124.97 109.39 22.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 71.0 111.083 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.65 131.7 36.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 70.450000000000003 110.832 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.451 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -117.62 102.4 9.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.24 -0.436 . . . . 73.540000000000006 110.898 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -138.76 142.59 38.8 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 75.310000000000002 110.833 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 59.06 35.96 24.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 32.43 111.117 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 59.88 31.14 20.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.431 . . . . 62.25 110.835 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -137.8 143.16 40.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.468 . . . . 74.430000000000007 110.954 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.451 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 3.7 mp -105.57 152.18 23.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 64.099999999999994 110.946 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 43.9 t -169.91 141.65 2.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 61.32 110.837 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.552 HG23 ' O ' ' A' ' 130' ' ' ARG . 44.5 mt -113.31 -36.39 2.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 74.329999999999998 111.175 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.804 ' HB3' HG21 ' B' ' 317' ' ' VAL . 9.0 p30 -87.9 -1.57 58.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 62.210000000000001 110.886 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 61.07 17.38 7.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 74.040000000000006 110.812 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -126.19 -32.29 2.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 74.109999999999999 110.902 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -114.03 104.85 17.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.491 . . . . 74.140000000000001 111.068 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -97.63 144.35 27.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 62.240000000000002 110.886 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -117.72 171.58 7.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 73.310000000000002 110.892 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.23 -15.45 31.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 72.099999999999994 110.914 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -175.27 158.65 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 75.299999999999997 110.919 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.433 ' N ' HD13 ' A' ' 138' ' ' LEU . 1.0 OUTLIER -51.43 -36.73 45.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.467 . . . . 74.019999999999996 110.897 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.1 ttt -51.84 -50.17 61.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 72.319999999999993 110.956 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.89 -41.6 82.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 73.420000000000002 110.925 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -47.38 77.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 71.150000000000006 110.918 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.474 HG21 ' CH2' ' A' ' 82' ' ' TRP . 89.7 t -63.77 -38.03 81.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 64.209999999999994 111.074 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -57.86 -38.33 75.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.137 -0.483 . . . . 74.200000000000003 110.852 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.81 -48.16 48.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 64.450000000000003 110.858 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.45 ' CD1' HD13 ' A' ' 163' ' ' LEU . 47.2 m-85 -67.02 -20.12 65.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 64.409999999999997 110.95 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 77.9 m -84.91 -30.07 24.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 64.409999999999997 111.167 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 72.3 m -79.69 -25.01 41.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.147 -0.479 . . . . 65.400000000000006 111.193 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.68 167.35 25.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 71.439999999999998 110.836 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.11 -57.88 7.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 54.109999999999999 111.109 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.09 17.45 9.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 55.240000000000002 110.882 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.55 15.92 9.89 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.756 -0.735 . . . . 63.299999999999997 112.451 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.45 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.8 mp -112.19 137.64 50.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.894 0.378 . . . . 63.119999999999997 110.935 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 23.7 t -51.51 -30.13 19.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.178 -0.465 . . . . 73.010000000000005 110.89 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.604 ' HB ' HG22 ' A' ' 101' ' ' THR . 2.6 t -151.45 120.47 6.68 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.176 -0.466 . . . . 73.239999999999995 111.101 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.09 151.81 4.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 75.239999999999995 110.897 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.439 ' CD1' HG13 ' A' ' 153' ' ' VAL . 6.4 mt -67.56 133.85 50.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.184 -0.462 . . . . 72.420000000000002 110.878 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.668 HD12 ' O ' ' A' ' 101' ' ' THR . 24.7 mt -127.03 -51.32 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 73.400000000000006 111.129 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -126.66 120.29 23.04 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.602 0.715 . . . . 75.129999999999995 110.911 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 135.08 29.52 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.677 2.251 . . . . 75.349999999999994 112.273 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 171' ' ' LYS . . . . . 0.504 ' HE2' HD22 ' A' ' 95' ' ' LEU . 0.3 OUTLIER -69.02 84.75 0.34 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 75.25 110.879 179.897 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 19.1 t -64.38 140.58 19.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 74.5 111.143 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 3.8 ptt? . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 65.439999999999998 110.882 179.968 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 CA-C-O 121.42 0.456 . . . . 73.140000000000001 112.512 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 161.53 45.58 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.721 2.281 . . . . 75.400000000000006 112.302 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 33.0 tp -53.32 -36.61 61.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 73.329999999999998 110.947 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 110.7 -20.25 24.97 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.756 -0.735 . . . . 72.340000000000003 112.443 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.93 144.04 27.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.903 0.383 . . . . 53.049999999999997 110.904 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -143.3 155.92 44.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.14 -0.482 . . . . 73.140000000000001 110.967 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -177.88 155.62 1.01 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.436 . . . . 71.510000000000005 110.835 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -157.14 78.34 0.89 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 75.129999999999995 110.903 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 13.1 p -174.76 89.58 0.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 74.430000000000007 110.844 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -159.27 114.42 2.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 33.509999999999998 110.817 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.554 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.0 OUTLIER -164.02 115.17 1.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 71.200000000000003 110.883 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.21 88.14 2.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.207 -0.451 . . . . 74.239999999999995 110.853 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -85.26 149.16 25.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.501 . . . . 65.25 110.888 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.32 128.69 16.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.14 -0.482 . . . . 74.329999999999998 110.93 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.39 158.71 18.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 73.200000000000003 110.862 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 28.2 mtt180 -58.12 -20.27 39.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 64.230000000000004 110.895 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 300' ' ' GLU . . . . . 0.511 ' HG2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -61.94 -36.5 81.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 75.319999999999993 110.884 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -99.32 -24.69 14.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.463 . . . . 73.010000000000005 110.926 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -143.69 79.16 13.81 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.663 0.744 . . . . 73.049999999999997 110.828 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 -5.69 16.78 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.661 2.241 . . . . 72.340000000000003 112.394 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.7 t -92.48 27.44 2.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 71.310000000000002 111.205 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 22.8 mt -102.9 136.71 42.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.462 . . . . 42.530000000000001 110.925 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.637 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.7 t -105.65 173.49 6.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 71.150000000000006 111.172 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -49.9 -37.4 31.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 71.340000000000003 110.84 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 34.6 tp10 -60.92 -52.14 66.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 65.510000000000005 110.932 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.637 ' HG2' HG22 ' B' ' 306' ' ' THR . 9.2 mm-40 -65.11 -51.94 58.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.07 -0.513 . . . . 74.140000000000001 110.916 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.616 HG22 ' HE2' ' B' ' 314' ' ' PTR . 45.5 mm -55.88 -54.35 27.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 63.399999999999999 111.122 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 50.6 m -62.85 -18.48 62.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 41.439999999999998 110.876 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -80.16 1.18 29.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 74.319999999999993 111.091 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 4.1 mtm -115.44 14.35 16.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.441 . . . . 73.209999999999994 110.957 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.616 ' HE2' HG22 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 38.1 t -111.42 -34.37 6.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.144 -1.389 . . . . 61.219999999999999 110.828 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 65.21 149.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 72.099999999999994 110.841 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.804 HG21 ' HB3' ' A' ' 141' ' ' ASP . 13.5 m -62.17 125.99 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 72.049999999999997 111.172 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -140.39 82.89 1.88 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 54.530000000000001 110.879 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.56 160.47 5.39 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.575 0.702 . . . . 42.119999999999997 110.912 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 113.52 3.41 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.727 2.285 . . . . 64.140000000000001 112.325 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 CA-C-O 119.142 -0.81 . . . . 51.509999999999998 112.537 179.967 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 CA-C-O 121.495 0.497 . . . . 65.040000000000006 112.472 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 -171.8 0.51 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.64 2.227 . . . . 74.200000000000003 112.382 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.9 mp -57.44 -48.05 80.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 63.530000000000001 110.947 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 169.37 -36.01 0.19 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.722 -0.751 . . . . 43.530000000000001 112.46 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 8.0 m -134.72 57.61 1.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.832 0.349 . . . . 62.25 110.789 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 mtp -129.97 73.83 81.07 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.6 0.714 . . . . 75.400000000000006 110.921 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 -7.82 22.02 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.729 2.286 . . . . 72.530000000000001 112.381 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.442 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 41.1 p-90 -102.28 -30.39 11.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.230000000000004 110.908 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -84.93 101.1 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 74.329999999999998 110.819 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.7 m80 -75.84 -37.5 58.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 75.109999999999999 110.848 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.55 18.62 38.28 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.774 -0.727 . . . . 54.130000000000003 112.52 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.92 80.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.812 0.339 . . . . 72.010000000000005 110.93 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 16.7 mm -141.42 144.29 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 75.209999999999994 111.085 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 m -98.7 160.42 14.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.15 -0.477 . . . . 63.140000000000001 111.168 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.83 -41.05 61.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.243 -0.435 . . . . 73.209999999999994 110.827 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -69.67 -36.0 75.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.257 -0.429 . . . . 70.329999999999998 110.902 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -70.28 -41.92 72.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 70.140000000000001 110.824 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.93 -33.85 59.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 45.240000000000002 111.1 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -58.81 -52.29 66.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 73.430000000000007 110.838 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.68 -37.36 79.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 64.049999999999997 110.866 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.3 mt -55.04 -38.29 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 63.409999999999997 110.94 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.67 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -100.32 43.61 1.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.447 . . . . 72.120000000000005 110.867 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.48 -60.13 5.13 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.68 0.752 . . . . 73.319999999999993 110.929 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.0 Cg_endo -69.76 123.43 10.09 Favored 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.696 2.264 . . . . 74.099999999999994 112.311 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.85 117.89 5.36 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.693 2.262 . . . . 72.030000000000001 112.308 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.82 104.95 2.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 75.209999999999994 110.864 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 168' ' ' ILE . 5.0 p -57.99 111.95 1.34 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.095 -0.502 . . . . 51.43 111.132 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.52 -6.24 6.25 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.744 -0.741 . . . . 41.439999999999998 112.55 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.73 112.62 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 73.25 110.913 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -123.96 166.55 15.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 73.530000000000001 110.915 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.598 HD23 HD21 ' A' ' 96' ' ' LEU . 0.9 OUTLIER -162.0 136.53 6.9 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 63.329999999999998 110.903 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.442 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 86.1 t -110.05 140.35 29.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 72.540000000000006 111.101 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -153.63 146.58 24.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 63.119999999999997 110.866 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -50.79 123.92 10.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.16 -0.473 . . . . 75.25 110.899 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.4 m -59.67 113.48 2.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 74.540000000000006 110.848 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.61 HG21 ' HB2' ' B' ' 298' ' ' SER . 2.2 m -68.55 -55.87 10.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 70.439999999999998 111.143 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -63.67 -29.26 70.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 61.409999999999997 110.934 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.429 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 1.2 m-85 -119.38 97.69 50.26 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.691 0.758 . . . . 72.329999999999998 110.884 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.6 Cg_endo -69.72 117.68 5.22 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.677 2.252 . . . . 73.340000000000003 112.347 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.61 -2.78 24.75 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.74 -0.743 . . . . 53.25 112.482 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -122.75 -176.33 3.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.866 0.365 . . . . 54.25 110.808 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -135.24 142.53 46.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 73.430000000000007 110.869 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.5 m -109.64 137.79 46.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.127 -0.488 . . . . 70.030000000000001 111.166 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.84 114.68 28.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 63.200000000000003 110.932 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.2 t -100.82 129.95 46.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 74.340000000000003 110.844 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.9 t -131.29 150.43 34.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 73.120000000000005 111.101 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.67 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -102.92 111.44 23.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.466 . . . . 74.329999999999998 110.828 -179.835 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.02 92.38 3.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.088 -0.506 . . . . 61.329999999999998 110.876 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 66.61 30.8 8.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 74.099999999999994 110.926 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 98.25 -13.64 62.99 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.727 -0.749 . . . . 73.299999999999997 112.535 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.78 140.02 29.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.855 0.359 . . . . 64.219999999999999 110.939 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.45 ' O ' HD22 ' B' ' 294' ' ' LEU . 6.7 m -101.3 105.53 17.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.266 -0.424 . . . . 63.409999999999997 111.082 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -97.11 129.67 44.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 74.340000000000003 110.855 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -106.66 124.3 49.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 73.109999999999999 110.845 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -111.96 102.98 11.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.261 -0.427 . . . . 65.540000000000006 110.95 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -59.68 140.09 56.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 71.200000000000003 110.859 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.501 HG12 HD11 ' A' ' 140' ' ' ILE . 42.2 mt -120.45 109.01 24.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.468 . . . . 63.130000000000003 111.147 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.38 130.45 40.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 75.109999999999999 110.884 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -116.74 113.51 22.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.232 -0.44 . . . . 73.239999999999995 110.886 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -146.26 136.89 24.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 74.400000000000006 110.829 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.15 35.85 23.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 75.099999999999994 111.043 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.32 30.53 15.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.269 -0.423 . . . . 62.310000000000002 110.829 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -130.6 138.28 50.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 75.510000000000005 110.933 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.57 HD21 ' HG ' ' A' ' 149' ' ' LEU . 3.7 mp -101.16 150.47 22.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 110.915 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -168.38 134.97 1.96 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 63.32 110.827 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.501 HD11 HG12 ' A' ' 131' ' ' ILE . 51.8 mt -113.32 -40.66 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 72.219999999999999 111.107 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.771 ' HB3' HG21 ' B' ' 317' ' ' VAL . 15.9 p30 -84.49 -5.64 59.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 64.209999999999994 110.919 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 61.57 16.29 7.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.109999999999999 110.853 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -125.36 -8.15 6.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 64.230000000000004 110.897 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 6.0 t -144.35 104.5 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 63.420000000000002 111.102 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -94.76 146.77 23.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.148 -0.478 . . . . 72.329999999999998 110.902 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -117.33 176.15 5.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 63.439999999999998 110.911 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -100.44 -14.56 18.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 73.120000000000005 110.861 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' ASN . . . . . 0.421 ' C ' HD13 ' A' ' 138' ' ' LEU . 1.9 t30 -167.05 171.87 10.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 74.340000000000003 110.918 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.57 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.6 OUTLIER -74.49 -22.72 58.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.15 -0.477 . . . . 53.340000000000003 110.907 179.95 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.2 ttt -61.58 -56.76 16.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 53.299999999999997 110.912 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -67.18 -36.3 81.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 70.329999999999998 110.943 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.26 -53.15 59.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 61.119999999999997 110.931 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.451 HG13 ' CD1' ' A' ' 167' ' ' LEU . 65.3 t -62.2 -36.74 76.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 53.340000000000003 111.14 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -54.78 -39.76 68.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.069 -0.514 . . . . 64.439999999999998 110.933 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -71.75 -49.01 42.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.13 -0.486 . . . . 73.239999999999995 110.838 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.408 ' CD1' HD13 ' A' ' 163' ' ' LEU . 38.3 m-85 -62.92 -23.67 67.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.233 -0.44 . . . . 71.109999999999999 110.939 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.553 ' OG1' HD12 ' A' ' 167' ' ' LEU . 94.1 m -83.96 -29.47 27.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.082 -0.508 . . . . 63.329999999999998 111.155 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 42.3 m -77.65 -23.52 49.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 71.109999999999999 111.164 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -165.24 160.17 18.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.205 -0.452 . . . . 71.439999999999998 110.857 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.91 -58.12 6.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 62.240000000000002 111.157 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 21.5 t70 55.87 25.11 8.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 71.219999999999999 110.834 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 118.73 -10.86 12.29 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.792 -0.718 . . . . 44.43 112.441 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.408 HD13 ' CD1' ' A' ' 156' ' ' TYR . 10.8 mp -87.21 138.66 31.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.87 0.367 . . . . 63.0 110.85 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 164' ' ' CYS . . . . . 0.465 ' SG ' HG22 ' A' ' 165' ' ' THR . 18.4 p -54.6 -26.31 31.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 71.129999999999995 110.936 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.465 HG22 ' SG ' ' A' ' 164' ' ' CYS . 9.2 t -157.54 124.98 5.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.133 -0.485 . . . . 61.119999999999997 111.128 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -52.66 147.9 7.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 71.299999999999997 110.815 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.553 HD12 ' OG1' ' A' ' 157' ' ' THR . 7.5 mt -65.93 138.83 58.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.1 -0.5 . . . . 74.340000000000003 110.915 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 101' ' ' THR . 24.9 mt -127.16 -51.29 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 63.450000000000003 111.094 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -129.93 122.25 20.3 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.531 0.681 . . . . 74.230000000000004 110.873 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.86 138.95 38.69 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.689 2.259 . . . . 52.530000000000001 112.287 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 84.13 0.42 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 64.299999999999997 110.85 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 15.2 m -64.37 130.75 29.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 53.43 111.12 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.310000000000002 110.845 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 CA-C-O 121.5 0.5 . . . . 71.329999999999998 112.431 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.87 169.99 17.75 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.713 2.275 . . . . 75.109999999999999 112.346 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 5.5 mp -52.6 -49.83 64.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 60.229999999999997 110.912 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 103.38 -40.89 2.28 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.762 -0.733 . . . . 72.120000000000005 112.503 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 13.0 t -103.53 131.93 50.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.934 0.397 . . . . 75.040000000000006 110.859 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.01 173.99 15.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 70.129999999999995 110.912 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.66 111.59 2.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 63.240000000000002 110.937 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -176.74 111.43 0.09 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 65.230000000000004 110.91 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 3.3 t -89.23 89.29 7.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.111 -0.495 . . . . 74.409999999999997 110.802 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 99.2 p -60.91 -172.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.495 . . . . 52.520000000000003 110.898 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.45 HD22 ' O ' ' A' ' 126' ' ' VAL . 0.0 OUTLIER -163.83 105.48 0.93 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.142 -0.481 . . . . 73.409999999999997 110.876 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.4 m -100.47 88.74 3.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 72.129999999999995 110.894 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -83.53 147.27 27.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 73.319999999999993 110.97 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.1 128.82 21.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.114 -0.493 . . . . 72.319999999999993 110.937 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 298' ' ' SER . . . . . 0.61 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -87.87 156.09 19.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 73.549999999999997 110.893 -179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -60.85 -18.0 53.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.459 . . . . 73.329999999999998 110.853 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.2 -39.05 86.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 74.430000000000007 110.848 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -92.5 -20.49 20.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 74.219999999999999 110.878 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.487 ' HB2' HD11 ' B' ' 305' ' ' LEU . 30.2 m-20 -148.84 81.36 7.71 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.674 0.749 . . . . 74.450000000000003 110.902 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -6.84 19.53 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.711 2.274 . . . . 74.439999999999998 112.374 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.3 t -94.13 27.3 2.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.205 -0.452 . . . . 70.420000000000002 111.097 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.632 HD13 ' OE2' ' B' ' 309' ' ' GLU . 62.2 mt -100.4 136.7 39.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.264 -0.425 . . . . 74.010000000000005 110.914 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.461 HG23 ' H ' ' B' ' 309' ' ' GLU . 7.2 t -93.82 152.99 18.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.454 . . . . 74.519999999999996 111.142 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -49.1 -31.83 8.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 65.230000000000004 110.9 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.77 -54.97 40.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 60.520000000000003 110.881 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.632 ' OE2' HD13 ' B' ' 305' ' ' LEU . 0.3 OUTLIER -57.15 -32.41 66.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 70.120000000000005 110.935 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.7 HG22 ' CE2' ' B' ' 314' ' ' PTR . 27.0 mm -63.31 -53.2 48.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 65.340000000000003 111.099 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.33 -21.26 63.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 70.25 110.868 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -76.88 -3.13 37.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.499 . . . . 62.039999999999999 111.139 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 313' ' ' MET . . . . . 0.635 ' HE2' ' HA ' ' B' ' 310' ' ' ILE . 2.6 mtm -111.82 6.39 19.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 72.349999999999994 110.822 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.7 ' CE2' HG22 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 43.9 t -73.15 -30.6 63.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.113 -1.403 . . . . 31.32 110.812 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 65.94 145.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 71.409999999999997 110.86 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.771 HG21 ' HB3' ' A' ' 141' ' ' ASP . 6.7 m -56.63 116.29 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 61.240000000000002 111.139 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -125.21 74.89 1.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 75.349999999999994 110.88 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 13.3 mtmt -54.65 160.48 2.74 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.652 0.739 . . . . 74.510000000000005 110.919 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.69 113.45 3.37 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.619 2.212 . . . . 64.340000000000003 112.409 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 CA-C-O 119.062 -0.855 . . . . 34.530000000000001 112.462 -179.993 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 CA-C-O 121.422 0.457 . . . . 64.140000000000001 112.471 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.449 ' HB2' HD23 ' A' ' 77' ' ' LEU . 54.5 Cg_endo -69.7 -41.44 4.35 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.656 2.237 . . . . 73.319999999999993 112.422 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.449 HD23 ' HB2' ' A' ' 76' ' ' PRO . 0.5 OUTLIER -155.44 33.34 0.37 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.136 -0.483 . . . . 63.130000000000003 110.849 -179.985 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 156.35 -104.73 0.26 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.805 -0.712 . . . . 63.32 112.54 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 7.0 m -149.06 64.5 1.04 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.856 0.36 . . . . 72.109999999999999 110.855 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 37.0 mtm -135.35 74.06 61.95 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.586 0.708 . . . . 64.299999999999997 110.894 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 -7.71 21.75 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.748 2.299 . . . . 75.25 112.323 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.42 ' CH2' HG21 ' A' ' 153' ' ' VAL . 34.2 p-90 -101.51 -30.9 11.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 73.239999999999995 110.908 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -87.32 99.48 12.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 75.010000000000005 110.851 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.3 m80 -75.71 -33.64 60.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 74.129999999999995 110.909 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.95 19.59 37.93 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.738 -0.744 . . . . 72.319999999999993 112.449 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.08 82.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.77 0.319 . . . . 75.510000000000005 110.919 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.625 HG23 ' HB3' ' A' ' 91' ' ' GLN . 29.5 mm -146.8 145.04 19.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 72.230000000000004 111.158 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.2 p -101.14 177.34 4.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 62.039999999999999 111.096 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -41.08 97.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 63.299999999999997 110.82 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -62.91 -38.26 90.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 72.540000000000006 110.938 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.625 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -75.73 -36.23 60.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.105 -0.498 . . . . 63.030000000000001 110.962 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.41 -33.83 67.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 73.040000000000006 111.101 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -68.69 -53.14 24.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 63.210000000000001 110.878 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.17 -40.03 96.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 64.450000000000003 110.856 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 91' ' ' GLN . 14.9 mt -58.63 -38.2 77.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 73.310000000000002 110.911 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.645 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -101.42 43.36 1.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 75.420000000000002 110.852 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.29 -60.13 4.39 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.68 0.752 . . . . 72.349999999999994 110.902 179.924 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.4 Cg_endo -69.72 124.08 10.75 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.615 2.21 . . . . 70.329999999999998 112.445 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 116.92 4.78 Favored 'Trans proline' 0 C--O 1.23 0.124 0 C-N-CA 122.704 2.269 . . . . 54.229999999999997 112.325 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -154.79 110.58 3.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 62.130000000000003 110.863 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.638 ' O ' HD12 ' A' ' 168' ' ' ILE . 1.1 p -62.71 111.8 2.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 63.310000000000002 111.114 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.76 -7.07 6.17 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.74 -0.743 . . . . 72.120000000000005 112.443 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.453 HD21 ' HE3' ' A' ' 171' ' ' LYS . 3.0 tp -89.51 111.59 22.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 73.540000000000006 110.969 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.469 ' HB3' HD22 ' A' ' 167' ' ' LEU . 19.6 p90 -123.31 167.7 13.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.213 -0.449 . . . . 74.420000000000002 110.885 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.586 HD23 HD21 ' A' ' 96' ' ' LEU . 1.0 OUTLIER -162.45 134.02 5.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 45.299999999999997 110.873 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.2 t -110.03 140.04 30.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 74.510000000000005 111.067 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.5 151.65 29.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 74.349999999999994 110.884 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -51.38 124.24 11.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 70.099999999999994 110.904 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.6 m -59.17 112.05 1.57 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 53.100000000000001 110.86 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.601 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.3 m -68.77 -56.46 7.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 61.130000000000003 111.126 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.43 ' CG ' HD12 ' B' ' 310' ' ' ILE . 30.8 m-80 -67.26 -24.99 65.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 62.100000000000001 110.915 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -116.42 95.43 45.51 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.69 0.757 . . . . 75.450000000000003 110.896 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 110.52 2.58 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.66 2.24 . . . . 63.240000000000002 112.353 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.7 6.31 21.41 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.707 -0.759 . . . . 42.140000000000001 112.461 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -132.44 -177.81 4.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.797 0.332 . . . . 71.549999999999997 110.841 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -129.01 155.83 44.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 70.010000000000005 110.88 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.483 HG23 ' HE1' ' B' ' 314' ' ' PTR . 2.9 m -125.84 139.94 53.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.07 -0.514 . . . . 75.140000000000001 111.123 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.71 115.01 26.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.197 -0.456 . . . . 72.310000000000002 110.931 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.6 t -100.83 126.97 47.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.420000000000002 110.889 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.4 t -127.81 153.28 36.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 74.409999999999997 111.127 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.645 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -104.24 111.76 24.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.461 . . . . 72.030000000000001 110.823 -179.787 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.47 92.37 3.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 44.409999999999997 110.844 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 66.95 31.25 7.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 65.019999999999996 110.89 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.71 -14.48 62.99 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.739 -0.743 . . . . 64.310000000000002 112.511 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -87.56 143.38 27.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.796 0.331 . . . . 61.119999999999997 110.916 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.587 ' O ' HD13 ' B' ' 294' ' ' LEU . 9.9 m -103.8 112.97 39.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 71.409999999999997 111.12 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.5 pm0 -105.54 126.56 52.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 70.409999999999997 110.913 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -103.33 126.46 50.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.171 -0.468 . . . . 73.319999999999993 110.854 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.433 ' HB3' HD13 ' A' ' 140' ' ' ILE . 32.0 m-85 -110.49 116.17 30.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 71.400000000000006 110.87 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.645 ' O ' HG23 ' A' ' 140' ' ' ILE . 0.0 OUTLIER -70.04 136.92 50.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.102 -0.499 . . . . 75.230000000000004 110.885 179.99 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.426 HG12 HD11 ' A' ' 140' ' ' ILE . 81.2 mt -118.61 109.28 26.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 52.109999999999999 111.101 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.11 130.41 39.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 73.420000000000002 110.853 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -114.09 116.67 29.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 74.129999999999995 110.878 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -150.35 136.07 18.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 72.319999999999993 110.852 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.11 35.93 23.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.198 -0.456 . . . . 60.130000000000003 111.108 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.71 29.98 14.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 63.25 110.889 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -129.29 142.24 50.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 72.129999999999995 110.887 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.589 HD21 ' HG ' ' A' ' 149' ' ' LEU . 2.1 mp -106.09 148.62 27.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 71.530000000000001 110.966 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.2 t -166.95 131.29 1.97 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.226 -0.443 . . . . 74.530000000000001 110.899 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.645 HG23 ' O ' ' A' ' 130' ' ' ARG . 41.0 mt -107.48 -32.25 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 64.409999999999997 111.13 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.471 ' HA ' HG21 ' B' ' 317' ' ' VAL . 35.6 t0 -86.59 -1.17 57.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 71.299999999999997 110.845 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 60.64 17.85 7.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 60.020000000000003 110.849 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -132.46 -38.43 1.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 70.239999999999995 110.961 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.0 t -104.49 104.55 17.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.075 -0.511 . . . . 72.010000000000005 111.109 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -98.78 146.02 26.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.18 -0.463 . . . . 75.200000000000003 110.95 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -116.71 178.25 4.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 73.150000000000006 110.895 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.5 -15.87 17.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.173 -0.467 . . . . 74.200000000000003 110.905 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -165.81 171.89 12.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 74.209999999999994 110.869 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.589 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.6 OUTLIER -75.05 -22.8 58.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 73.340000000000003 110.909 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -56.76 13.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 74.25 110.875 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -65.86 -35.2 79.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 53.539999999999999 110.913 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.35 -52.69 62.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 61.5 110.975 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.488 HG13 ' CD1' ' A' ' 167' ' ' LEU . 75.0 t -62.67 -36.61 76.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 73.129999999999995 111.126 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -55.02 -39.29 68.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.117 -0.492 . . . . 74.340000000000003 110.887 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.97 -45.99 58.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 74.340000000000003 110.887 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.424 ' CD1' HD13 ' A' ' 163' ' ' LEU . 36.2 m-85 -65.63 -23.68 66.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 64.209999999999994 110.99 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 87.3 m -84.14 -28.94 27.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 74.409999999999997 111.131 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 29.1 m -77.67 -26.21 50.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 61.130000000000003 111.163 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -165.03 162.85 20.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 71.340000000000003 110.892 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.99 -58.4 6.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 52.210000000000001 111.126 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 32.0 t70 57.93 21.69 7.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 72.409999999999997 110.876 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.27 7.33 21.11 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.803 -0.713 . . . . 44.439999999999998 112.518 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.424 HD13 ' CD1' ' A' ' 156' ' ' TYR . 7.8 mp -100.66 138.92 37.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.787 0.327 . . . . 73.409999999999997 110.959 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 36.1 t -51.35 -30.8 19.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 41.310000000000002 110.889 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 9.5 t -158.47 126.17 5.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 74.239999999999995 111.184 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -51.69 152.41 2.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 71.430000000000007 110.823 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.488 ' CD1' HG13 ' A' ' 153' ' ' VAL . 9.9 mt -74.33 139.04 43.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 63.020000000000003 110.847 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.638 HD12 ' O ' ' A' ' 101' ' ' THR . 26.1 mt -127.14 -51.18 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 65.109999999999999 111.124 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 169' ' ' LYS . . . . . 0.408 ' O ' HD12 ' A' ' 103' ' ' LEU . 4.1 mtmt -130.19 119.44 18.69 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.596 0.712 . . . . 73.430000000000007 110.831 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 140.76 43.39 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.716 2.277 . . . . 72.319999999999993 112.287 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 171' ' ' LYS . . . . . 0.453 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -69.65 83.76 0.44 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.163 -0.472 . . . . 64.010000000000005 110.899 179.895 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 30.2 m -64.45 126.28 22.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 74.310000000000002 111.154 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.4 mtm . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 61.210000000000001 110.894 179.949 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 CA-C-O 121.438 0.466 . . . . 75.230000000000004 112.46 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 168.9 20.23 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.674 2.249 . . . . 72.129999999999995 112.341 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.07 -35.45 66.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.23 -0.441 . . . . 72.329999999999998 110.85 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 96.92 29.16 8.24 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.802 -0.713 . . . . 72.510000000000005 112.511 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 63.0 p -82.3 141.9 32.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.873 0.368 . . . . 65.549999999999997 110.949 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -78.18 105.17 9.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 53.130000000000003 110.891 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -179.38 124.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 74.310000000000002 110.879 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -114.05 -176.42 2.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.448 . . . . 75.140000000000001 110.905 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 3.0 p 178.79 93.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.109 -0.496 . . . . 55.140000000000001 110.898 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -168.06 97.16 0.44 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 60.25 110.774 -179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.587 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER -164.41 88.57 0.5 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.474 . . . . 63.149999999999999 110.895 179.939 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.74 91.07 8.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 72.299999999999997 110.865 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -79.85 149.59 30.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 73.430000000000007 110.907 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -144.34 129.18 18.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.067 -0.515 . . . . 72.329999999999998 110.944 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 298' ' ' SER . . . . . 0.601 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -94.89 158.37 15.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 74.510000000000005 110.905 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -62.75 -16.64 58.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.181 -0.463 . . . . 74.200000000000003 110.871 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -39.28 90.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 71.25 110.852 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -90.61 -25.38 20.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 64.129999999999995 110.812 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.494 ' HB2' HD11 ' B' ' 305' ' ' LEU . 12.5 m-20 -147.03 84.97 7.14 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.627 0.727 . . . . 72.540000000000006 110.882 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.76 -6.6 19.0 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.699 2.266 . . . . 75.150000000000006 112.367 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.2 t -94.39 27.36 2.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 74.219999999999999 111.149 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.643 HD13 ' OE2' ' B' ' 309' ' ' GLU . 57.3 mt -101.11 136.83 40.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 72.219999999999999 110.879 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.461 HG23 ' H ' ' B' ' 309' ' ' GLU . 10.1 t -92.02 152.89 19.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 73.25 111.116 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -49.89 -31.2 11.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 75.540000000000006 110.895 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -54.07 50.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 74.409999999999997 110.865 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.643 ' OE2' HD13 ' B' ' 305' ' ' LEU . 0.3 OUTLIER -58.92 -32.45 69.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 64.109999999999999 110.91 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.43 HD12 ' CG ' ' A' ' 111' ' ' ASN . 30.5 mm -62.08 -53.67 44.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.152 -0.476 . . . . 53.130000000000003 111.076 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 1.1 p -56.9 -30.78 64.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 71.430000000000007 110.926 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -64.39 -15.14 59.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.513 . . . . 60.32 111.108 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 313' ' ' MET . . . . . 0.408 ' HE2' ' HA ' ' B' ' 310' ' ' ILE . 1.6 mtm -104.94 8.0 34.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 74.200000000000003 110.925 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.483 ' HE1' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -96.35 -35.57 11.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.102 -1.408 . . . . 63.119999999999997 110.829 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.3 156.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 72.340000000000003 110.837 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.471 HG21 ' HA ' ' A' ' 141' ' ' ASP . 5.7 m -51.41 130.09 11.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.06 -0.518 . . . . 60.219999999999999 111.138 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -145.76 75.01 1.41 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.192 -0.458 . . . . 72.430000000000007 110.891 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.08 160.14 1.28 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.593 0.711 . . . . 73.420000000000002 110.879 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 111.59 2.86 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.694 2.263 . . . . 62.140000000000001 112.352 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 CA-C-O 119.158 -0.801 . . . . 72.25 112.502 -179.994 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 CA-C-O 121.41 0.45 . . . . 74.219999999999999 112.484 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 -8.18 22.96 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.68 2.253 . . . . 72.319999999999993 112.324 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 63.81 23.04 13.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 72.299999999999997 110.884 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.1 -67.19 1.95 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.694 -0.765 . . . . 71.239999999999995 112.5 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 7.7 p -142.48 30.27 1.54 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.895 0.378 . . . . 71.540000000000006 110.912 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.82 75.62 9.95 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.588 0.708 . . . . 71.430000000000007 110.822 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.74 -25.55 28.58 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.661 2.241 . . . . 53.229999999999997 112.406 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.466 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 47.6 p-90 -54.83 -25.75 30.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 71.340000000000003 110.919 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -90.66 99.26 12.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 74.140000000000001 110.899 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.6 m80 -75.96 -41.99 49.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.106 -0.497 . . . . 74.329999999999998 110.906 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.54 25.39 55.17 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.731 -0.747 . . . . 72.030000000000001 112.541 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.4 65.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 63.210000000000001 110.875 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.617 HG23 ' HB3' ' A' ' 91' ' ' GLN . 26.8 mm -136.06 145.25 31.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 73.099999999999994 111.084 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.9 p -97.48 177.09 5.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 73.239999999999995 111.15 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -65.98 -39.46 90.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 73.150000000000006 110.822 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.92 -37.63 88.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.261 -0.427 . . . . 71.319999999999993 110.897 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.617 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -76.01 -37.83 58.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.506 . . . . 73.530000000000001 110.904 -179.865 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.57 -33.98 67.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 65.200000000000003 111.118 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -67.14 -53.14 33.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 62.310000000000002 110.886 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -40.06 94.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 72.099999999999994 110.896 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.6 mt -56.41 -38.85 72.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 73.219999999999999 110.95 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.675 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.5 mm? -99.48 43.26 1.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 63.140000000000001 110.902 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.11 -60.04 4.62 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.717 0.77 . . . . 71.310000000000002 110.891 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.5 Cg_endo -69.79 123.99 10.63 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.728 2.286 . . . . 64.349999999999994 112.315 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.65 117.69 5.23 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.706 2.27 . . . . 73.409999999999997 112.38 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -155.12 103.67 2.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 71.129999999999995 110.841 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.657 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -57.33 111.83 1.21 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 72.530000000000001 111.116 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.34 -8.92 5.93 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.761 -0.733 . . . . 32.130000000000003 112.523 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.6 tp -88.07 111.89 22.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.891 0.377 . . . . 71.209999999999994 110.875 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.453 ' HB2' HD11 ' A' ' 118' ' ' LEU . 25.7 p90 -123.54 165.31 17.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 74.430000000000007 110.888 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.624 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -161.58 137.34 7.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.478 . . . . 61.219999999999999 110.883 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.466 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 91.1 t -109.52 129.91 63.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.221 -0.445 . . . . 51.409999999999997 111.15 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.91 137.93 29.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 71.040000000000006 110.946 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.4 126.96 18.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.45 . . . . 73.150000000000006 110.935 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.0 m -55.57 114.01 1.68 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 73.319999999999993 110.794 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 m -70.07 -49.16 53.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.135 -0.484 . . . . 64.340000000000003 111.098 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.405 ' ND2' HD12 ' B' ' 310' ' ' ILE . 16.7 p30 -80.16 -3.17 47.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 71.510000000000005 110.932 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -139.48 88.6 12.52 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.615 0.721 . . . . 72.129999999999995 110.897 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 122.29 8.98 Favored 'Trans proline' 0 C--N 1.34 0.117 0 C-N-CA 122.679 2.252 . . . . 70.219999999999999 112.341 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.87 -8.21 23.62 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.714 -0.755 . . . . 54.530000000000001 112.567 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -127.94 -179.64 5.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.759 0.314 . . . . 65.299999999999997 110.9 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -130.86 164.33 25.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 73.239999999999995 110.94 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.435 HG23 ' HE2' ' B' ' 314' ' ' PTR . 97.3 m -143.87 128.16 17.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 72.150000000000006 111.138 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.453 HD11 ' HB2' ' A' ' 104' ' ' PHE . 0.3 OUTLIER -97.31 132.75 42.74 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.272 -0.422 . . . . 42.439999999999998 110.917 179.909 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 5.8 m -113.02 126.54 55.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.166 -0.47 . . . . 74.439999999999998 110.908 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.3 t -126.61 152.37 34.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 53.329999999999998 111.116 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.675 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -104.66 111.9 24.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 60.210000000000001 110.87 -179.877 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -115.26 93.04 4.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 25.050000000000001 110.911 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 66.68 31.03 7.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 73.200000000000003 110.887 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.31 -12.87 65.0 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.79 -0.719 . . . . 44.100000000000001 112.491 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.18 139.91 30.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.805 0.336 . . . . 73.519999999999996 110.906 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.528 ' O ' HD13 ' B' ' 294' ' ' LEU . 92.6 t -99.93 111.21 28.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.24 -0.436 . . . . 65.239999999999995 111.21 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -102.89 129.9 49.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 74.099999999999994 110.866 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -105.36 127.28 52.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 74.5 110.824 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.63 ' CZ ' HD13 ' A' ' 163' ' ' LEU . 44.7 m-85 -113.71 111.11 21.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.29 -0.414 . . . . 61.020000000000003 110.93 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -63.32 137.16 58.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.066 -0.516 . . . . 65.310000000000002 110.841 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.468 ' CG2' HD23 ' A' ' 138' ' ' LEU . 54.3 mt -119.66 109.43 26.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.139 -0.482 . . . . 73.420000000000002 111.132 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -84.63 121.4 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.340000000000003 110.954 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.476 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -110.5 98.11 7.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.327 -0.397 . . . . 71.049999999999997 111.013 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -132.03 142.65 49.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.463 . . . . 62.100000000000001 110.844 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.55 35.95 26.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 40.25 111.165 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 12.5 t 61.31 30.12 18.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 65.420000000000002 110.812 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -135.57 143.56 45.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.466 . . . . 75.239999999999995 110.942 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.476 HD21 ' CE2' ' A' ' 133' ' ' TYR . 4.0 mp -106.37 149.8 26.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 63.32 110.966 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.27 140.82 5.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 60.0 110.836 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.479 HG22 HG13 ' B' ' 317' ' ' VAL . 49.8 mt -115.61 -34.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 72.209999999999994 111.148 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.716 ' CB ' HG21 ' B' ' 317' ' ' VAL . 31.6 p-10 -96.65 11.53 35.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 71.239999999999995 110.875 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 6.6 pt-20 45.76 30.73 0.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 74.099999999999994 110.898 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -131.88 -39.96 1.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.112 -0.494 . . . . 70.420000000000002 110.906 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' VAL . . . . . 0.443 ' O ' HG13 ' A' ' 144' ' ' VAL . 2.6 p -116.6 104.51 16.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 61.350000000000001 111.087 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -93.0 148.91 21.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 75.209999999999994 110.957 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -119.4 177.71 4.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 54.229999999999997 110.821 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -100.52 -15.52 17.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 53.340000000000003 110.919 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -165.81 172.12 12.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 64.310000000000002 110.883 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -22.57 59.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 63.109999999999999 110.912 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.2 ttp -62.73 -57.0 12.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.471 . . . . 75.510000000000005 110.84 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -66.17 -35.56 80.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 73.319999999999993 110.948 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.45 -49.9 71.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 74.450000000000003 110.923 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.722 HG13 HD12 ' A' ' 167' ' ' LEU . 73.8 t -64.01 -38.19 81.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.183 -0.462 . . . . 54.049999999999997 111.192 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.84 -38.17 67.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.11 -0.495 . . . . 62.140000000000001 110.926 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.24 -46.1 57.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 71.530000000000001 110.888 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.414 ' CD1' HD23 ' A' ' 163' ' ' LEU . 35.6 m-85 -70.86 -11.28 60.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.217 -0.447 . . . . 73.329999999999998 110.938 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.4 m -92.2 -32.43 15.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.105 -0.498 . . . . 62.439999999999998 111.128 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 5.7 t -80.35 -25.64 39.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.304 -0.407 . . . . 71.510000000000005 111.078 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -157.53 158.06 34.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.304 -0.407 . . . . 75.340000000000003 110.853 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.89 -56.48 12.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 72.430000000000007 111.103 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 58.12 22.63 9.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 74.409999999999997 110.846 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.28 11.17 18.65 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.752 . . . . 62.439999999999998 112.466 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.63 HD13 ' CZ ' ' A' ' 129' ' ' TYR . 3.1 mm? -105.62 134.5 48.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.928 0.394 . . . . 72.230000000000004 110.943 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 23.5 t -51.71 -29.71 19.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.148 -0.478 . . . . 63.5 110.849 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.4 ' HB ' HG22 ' A' ' 101' ' ' THR . 3.0 t -153.03 120.44 5.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 70.5 111.116 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -53.54 143.0 20.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 73.5 110.913 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.722 HD12 HG13 ' A' ' 153' ' ' VAL . 7.7 mt -61.56 135.58 57.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 44.420000000000002 110.888 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.657 HD12 ' O ' ' A' ' 101' ' ' THR . 27.0 mt -127.19 -51.41 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 64.430000000000007 111.117 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.4 120.04 22.01 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.605 0.717 . . . . 73.439999999999998 110.841 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 133.83 26.48 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.699 2.266 . . . . 73.420000000000002 112.302 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.94 83.67 0.49 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 61.399999999999999 110.883 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.8 m -64.55 144.97 14.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 61.32 111.173 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 7.8 ptm . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 71.340000000000003 110.886 179.92 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.269 0 CA-C-O 121.505 0.503 . . . . 72.0 112.455 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 169.65 18.42 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.683 2.255 . . . . 53.200000000000003 112.383 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 6.5 mt -53.54 -46.93 70.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 74.5 110.859 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 108.15 -21.48 29.05 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.781 -0.724 . . . . 61.25 112.487 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 1.5 m -147.4 89.81 1.81 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.948 0.404 . . . . 73.409999999999997 110.838 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.76 100.79 1.62 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.09 -0.504 . . . . 50.340000000000003 110.856 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -172.19 170.86 5.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 75.310000000000002 110.887 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -159.57 64.92 0.37 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 73.349999999999994 110.932 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 10.3 p -176.42 79.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.091 -0.504 . . . . 71.140000000000001 110.863 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 33.3 t -130.26 109.19 10.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 62.109999999999999 110.899 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER -164.07 110.74 1.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 34.439999999999998 110.915 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 3.3 t -110.17 88.4 2.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 75.349999999999994 110.883 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -83.46 149.43 26.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.211 -0.45 . . . . 65.430000000000007 110.975 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.71 129.39 10.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 75.540000000000006 110.891 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.25 170.89 9.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.209 -0.45 . . . . 55.130000000000003 110.888 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -63.8 -15.58 59.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 72.310000000000002 110.914 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.47 -38.58 91.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 73.340000000000003 110.848 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -104.08 -26.14 12.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.16 -0.473 . . . . 74.109999999999999 110.876 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.515 ' HB2' HD11 ' B' ' 305' ' ' LEU . 31.0 m-20 -138.33 77.8 34.68 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.594 0.712 . . . . 64.319999999999993 110.897 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.73 -6.15 17.89 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.674 2.249 . . . . 64.120000000000005 112.308 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.3 t -93.64 27.27 2.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.434 . . . . 75.420000000000002 111.069 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.515 HD11 ' HB2' ' B' ' 302' ' ' ASP . 36.0 mt -103.11 136.65 42.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.269 -0.423 . . . . 72.5 110.997 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.65 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.7 t -107.12 173.69 6.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.438 . . . . 72.340000000000003 111.171 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 26.8 pt-20 -49.26 -37.63 24.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 72.319999999999993 110.793 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -61.38 -52.0 66.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 74.310000000000002 110.916 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.65 ' HG2' HG22 ' B' ' 306' ' ' THR . 9.1 mm-40 -63.29 -52.45 61.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 53.200000000000003 110.878 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.604 HG22 ' HE1' ' B' ' 314' ' ' PTR . 46.2 mm -56.33 -54.06 32.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.468 . . . . 43.130000000000003 111.098 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 22.8 t -60.33 -19.92 57.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 75.310000000000002 110.882 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.0 3.0 28.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.092 -0.504 . . . . 43.25 111.102 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 313' ' ' MET . . . . . 0.447 ' CE ' HD13 ' B' ' 310' ' ' ILE . 1.8 mtm -115.49 14.46 16.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 61.539999999999999 110.887 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.604 ' HE1' HG22 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 16.2 t -105.73 -39.2 6.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.084 -1.417 . . . . 74.120000000000005 110.838 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.44 139.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.475 . . . . 63.329999999999998 110.87 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.716 HG21 ' CB ' ' A' ' 141' ' ' ASP . 5.6 m -50.93 122.24 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 73.420000000000002 111.188 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -131.85 80.88 1.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.932 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt -58.62 160.41 10.29 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.599 0.714 . . . . 71.530000000000001 110.917 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 111.53 2.84 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.707 2.272 . . . . 63.43 112.351 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 CA-C-O 119.14 -0.811 . . . . 33.100000000000001 112.472 179.978 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 CA-C-O 121.44 0.467 . . . . 63.210000000000001 112.494 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -32.04 19.1 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.698 2.265 . . . . 71.430000000000007 112.304 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.26 25.76 11.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 62.329999999999998 110.868 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.17 -55.15 25.55 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.73 -0.747 . . . . 55.399999999999999 112.536 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 25.1 t -118.74 28.91 8.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.898 0.38 . . . . 72.109999999999999 110.856 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.13 74.35 5.53 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.571 0.7 . . . . 73.519999999999996 110.824 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.84 -25.34 28.35 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.632 2.221 . . . . 73.310000000000002 112.324 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.452 ' CH2' HG21 ' A' ' 153' ' ' VAL . 47.1 p-90 -54.54 -27.18 36.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.251 -0.431 . . . . 73.040000000000006 110.899 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -87.45 99.48 12.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 64.409999999999997 110.997 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.5 m80 -75.6 -39.62 57.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.16 -0.473 . . . . 75.299999999999997 110.914 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.65 23.91 38.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.788 -0.72 . . . . 71.0 112.557 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.53 70.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.798 0.332 . . . . 73.310000000000002 110.913 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.626 HG23 ' HB3' ' A' ' 91' ' ' GLN . 26.4 mm -138.95 145.14 28.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.425 . . . . 74.310000000000002 111.152 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.7 p -97.4 177.17 5.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.21 -0.45 . . . . 64.219999999999999 111.154 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -39.33 89.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.221 -0.445 . . . . 73.349999999999994 110.919 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -64.04 -37.54 87.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 71.219999999999999 110.884 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.626 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -76.13 -38.57 56.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 75.129999999999995 110.94 -179.936 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.27 -36.45 79.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 71.129999999999995 111.044 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.61 -53.15 30.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 73.040000000000006 110.88 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.99 -34.51 78.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 73.140000000000001 110.876 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.29 -35.69 81.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 73.25 110.89 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.618 HD12 ' HB3' ' A' ' 121' ' ' SER . 2.4 mm? -104.89 43.74 1.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 73.510000000000005 110.91 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.45 -59.94 5.37 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.604 0.716 . . . . 72.010000000000005 110.919 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.0 Cg_endo -69.81 122.66 9.32 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.647 2.232 . . . . 72.329999999999998 112.307 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 117.61 5.19 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.66 2.24 . . . . 63.210000000000001 112.369 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -154.99 103.48 2.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.196 -0.456 . . . . 75.319999999999993 110.938 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.681 ' O ' HD12 ' A' ' 168' ' ' ILE . 10.8 p -56.14 111.93 1.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.456 . . . . 54.329999999999998 111.186 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.54 -10.8 5.79 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.77 -0.728 . . . . 63.229999999999997 112.546 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -87.8 111.83 21.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.329 . . . . 74.5 110.923 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.454 ' HB3' HD22 ' A' ' 167' ' ' LEU . 23.4 p90 -123.79 162.09 23.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 73.230000000000004 110.889 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.559 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -157.65 136.58 11.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.117 -0.492 . . . . 74.340000000000003 110.985 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.442 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 88.6 t -109.6 139.54 32.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 65.239999999999995 111.23 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.417 ' NH2' HG21 ' A' ' 117' ' ' THR . 0.0 OUTLIER -151.91 144.55 24.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 62.109999999999999 110.805 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.74 124.05 10.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 41.530000000000001 110.926 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.3 m -59.47 118.75 6.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 65.25 110.941 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.643 HG21 ' HB2' ' B' ' 298' ' ' SER . 3.8 m -68.65 -56.38 8.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 75.019999999999996 111.215 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.545 ' CG ' HD12 ' B' ' 310' ' ' ILE . 1.2 m-80 -70.49 -29.21 65.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 70.420000000000002 110.915 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -107.88 92.72 9.42 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.665 0.745 . . . . 73.349999999999994 110.878 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 112.94 3.22 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.612 2.208 . . . . 62.310000000000002 112.399 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.54 -4.84 24.72 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.699 -0.763 . . . . 64.230000000000004 112.499 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -121.17 -178.9 3.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.824 0.345 . . . . 72.230000000000004 110.857 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' TYR . . . . . 0.512 ' HB2' HD12 ' A' ' 131' ' ' ILE . 60.0 m-85 -125.52 171.5 10.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.431 . . . . 73.140000000000001 110.94 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.693 HG23 ' HE1' ' B' ' 314' ' ' PTR . 99.2 m -139.42 122.82 17.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 52.039999999999999 111.126 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.43 112.49 25.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 72.329999999999998 110.89 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 42.9 t -101.33 124.14 46.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 65.329999999999998 110.879 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.8 t -121.75 150.21 25.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 72.450000000000003 111.115 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' SER . . . . . 0.618 ' HB3' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -98.25 110.82 23.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 72.310000000000002 110.895 -179.832 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.04 90.35 3.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.127 -0.488 . . . . 64.430000000000007 110.937 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 66.1 32.78 7.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 74.319999999999993 110.856 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.48 -13.8 63.93 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.758 -0.734 . . . . 72.510000000000005 112.507 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -87.89 146.39 25.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.835 0.35 . . . . 55.119999999999997 110.9 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.658 ' O ' HD13 ' B' ' 294' ' ' LEU . 5.8 m -106.53 104.13 16.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.216 -0.447 . . . . 73.010000000000005 111.13 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -89.47 112.69 23.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 72.430000000000007 110.884 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -92.6 124.85 36.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 73.099999999999994 110.846 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.442 ' HB3' HD13 ' A' ' 140' ' ' ILE . 80.4 m-85 -118.36 106.71 13.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 73.329999999999998 110.93 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 6.7 ttp-105 -70.23 136.77 50.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.056 -0.52 . . . . 61.130000000000003 110.863 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.512 HD12 ' HB2' ' A' ' 116' ' ' TYR . 58.2 mt -110.83 108.42 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 75.5 111.153 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.65 124.79 26.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 64.409999999999997 110.937 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.462 ' CD2' HD21 ' A' ' 138' ' ' LEU . 0.1 OUTLIER -109.53 104.52 13.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 72.329999999999998 110.951 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -144.26 143.25 30.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.477 . . . . 73.109999999999999 110.913 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 60.39 39.93 18.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 63.219999999999999 111.128 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 56.87 24.09 8.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.254 -0.43 . . . . 72.430000000000007 110.843 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 7.3 mtmm -131.47 162.94 29.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.135 -0.484 . . . . 74.230000000000004 110.917 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.462 HD21 ' CD2' ' A' ' 133' ' ' TYR . 1.1 mt -124.52 148.57 47.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.214 -0.448 . . . . 75.040000000000006 110.943 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 7.2 t -166.44 145.75 5.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 64.329999999999998 110.908 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.55 HG22 HG13 ' B' ' 317' ' ' VAL . 56.1 mt -115.58 -28.75 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 73.310000000000002 111.123 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.622 ' HB3' HG21 ' B' ' 317' ' ' VAL . 4.3 p30 -101.25 12.76 36.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 73.040000000000006 110.906 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.441 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 7.1 pt-20 46.9 27.93 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 71.310000000000002 110.906 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -133.12 -37.77 0.97 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.49 . . . . 65.150000000000006 110.899 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 1.4 t -110.65 104.64 17.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.092 -0.503 . . . . 74.129999999999995 111.077 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -97.56 138.05 35.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 72.439999999999998 110.97 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.575 ' CD1' HD12 ' A' ' 152' ' ' LEU . 43.8 m-85 -114.43 176.52 5.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 72.010000000000005 110.909 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.58 -14.58 18.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 55.030000000000001 110.904 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -165.51 172.18 12.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 72.109999999999999 110.899 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.614 HD13 HD22 ' A' ' 152' ' ' LEU . 0.1 OUTLIER -74.63 -22.4 58.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 73.120000000000005 110.91 179.988 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -62.73 -57.12 12.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 65.5 110.896 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.53 -36.3 83.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 62.130000000000003 110.976 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.614 HD22 HD13 ' A' ' 149' ' ' LEU . 0.9 OUTLIER -55.21 -53.22 58.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 63.229999999999997 110.932 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.558 HG13 HD12 ' A' ' 167' ' ' LEU . 67.2 t -60.77 -37.52 76.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 75.25 111.11 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -55.06 -39.02 68.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 74.319999999999993 110.832 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -71.78 -46.54 57.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 75.209999999999994 110.884 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.434 ' CD1' HD13 ' A' ' 163' ' ' LEU . 39.1 m-85 -66.37 -21.23 66.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 75.120000000000005 110.885 -179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 92.0 m -84.18 -31.28 25.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 73.129999999999995 111.131 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 61.7 m -78.29 -24.42 46.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 74.400000000000006 111.137 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -165.64 157.84 14.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 74.010000000000005 110.885 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -51.26 -58.26 6.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 70.310000000000002 111.089 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 53.92 27.54 7.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 71.510000000000005 110.855 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 118.88 3.99 13.13 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 53.409999999999997 112.509 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.464 ' O ' ' HB1' ' A' ' 160' ' ' ALA . 9.5 mp -106.67 140.95 38.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 73.140000000000001 110.871 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 164' ' ' CYS . . . . . 0.436 ' SG ' HG22 ' A' ' 165' ' ' THR . 18.2 p -54.44 -26.38 30.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 51.0 110.885 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.436 HG22 ' SG ' ' A' ' 164' ' ' CYS . 9.0 t -162.64 129.55 3.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 74.409999999999997 111.105 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -53.13 161.39 0.86 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 71.439999999999998 110.777 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.558 HD12 HG13 ' A' ' 153' ' ' VAL . 10.4 mt -79.21 141.41 37.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 65.420000000000002 110.886 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.681 HD12 ' O ' ' A' ' 101' ' ' THR . 23.1 mt -127.18 -51.4 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 75.209999999999994 111.167 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.6 mtpt -130.13 123.18 20.59 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.577 0.703 . . . . 73.340000000000003 110.937 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 138.3 37.6 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.721 2.281 . . . . 61.549999999999997 112.303 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.1 83.62 0.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 73.120000000000005 110.931 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 21.1 t -64.2 136.9 25.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 72.200000000000003 111.089 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.6 ptt? . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 75.349999999999994 110.87 179.888 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.236 0 CA-C-O 121.424 0.458 . . . . 52.140000000000001 112.455 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 166.15 28.54 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.739 2.293 . . . . 65.25 112.296 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 9.5 mp -58.67 -29.83 66.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 75.340000000000003 110.907 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 65.75 24.78 71.49 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.727 -0.749 . . . . 74.219999999999999 112.488 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 1.2 m -68.22 102.59 1.39 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.906 0.384 . . . . 51.240000000000002 110.903 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.92 120.01 9.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 74.25 110.796 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -174.07 142.34 0.83 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 74.349999999999994 110.878 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -128.54 67.75 1.38 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 75.540000000000006 110.917 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.0 86.33 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 53.420000000000002 110.866 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 21.5 t -139.89 110.56 6.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.071 -0.513 . . . . 43.329999999999998 110.834 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.658 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER -163.8 103.8 0.91 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 72.420000000000002 110.918 -179.95 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 6.0 t -102.65 88.83 3.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 74.439999999999998 110.852 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -83.75 147.82 27.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.109 -0.496 . . . . 74.120000000000005 110.942 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -145.56 129.14 17.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.071 -0.513 . . . . 74.120000000000005 110.858 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 298' ' ' SER . . . . . 0.643 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -88.52 162.16 16.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 42.149999999999999 110.917 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -62.2 -16.89 56.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 74.140000000000001 110.838 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -36.88 84.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.434 . . . . 72.040000000000006 110.882 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -98.32 -19.98 17.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.489 . . . . 63.539999999999999 110.87 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.513 ' HB2' HD11 ' B' ' 305' ' ' LEU . 53.1 m-20 -149.39 79.73 8.02 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.559 0.695 . . . . 63.539999999999999 110.791 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 -6.6 18.98 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.754 2.303 . . . . 71.230000000000004 112.315 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.6 t -94.11 27.27 2.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.44 . . . . 64.510000000000005 111.102 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.513 HD11 ' HB2' ' B' ' 302' ' ' ASP . 48.6 mt -100.24 136.92 39.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.225 -0.443 . . . . 62.530000000000001 110.933 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.618 HG22 ' HG2' ' B' ' 309' ' ' GLU . 12.0 t -107.75 174.53 5.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 61.520000000000003 111.133 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -50.07 -37.86 35.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.212 -0.449 . . . . 75.209999999999994 110.84 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -60.95 -49.71 76.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 74.540000000000006 110.925 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.618 ' HG2' HG22 ' B' ' 306' ' ' THR . 20.9 mm-40 -66.69 -51.95 50.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.159 -0.473 . . . . 73.409999999999997 110.945 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.545 HD12 ' CG ' ' A' ' 111' ' ' ASN . 44.6 mm -56.05 -53.75 35.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.119 -0.491 . . . . 64.099999999999994 111.094 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 82.8 p -59.8 -25.24 64.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 74.310000000000002 110.806 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -77.98 -2.66 38.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.48 . . . . 74.200000000000003 111.071 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.09 -3.2 23.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 70.0 110.895 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.693 ' HE1' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.1 -32.43 10.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.159 -1.382 . . . . 73.109999999999999 110.871 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.29 155.65 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 74.420000000000002 110.865 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.622 HG21 ' HB3' ' A' ' 141' ' ' ASP . 4.7 m -51.38 121.31 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 65.420000000000002 111.13 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -135.92 74.96 1.53 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 52.420000000000002 110.797 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 22.1 mttt -55.34 160.54 3.47 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.63 0.729 . . . . 62.039999999999999 110.875 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.66 112.74 3.14 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.735 2.29 . . . . 75.310000000000002 112.392 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.364 0 CA-C-O 119.084 -0.842 . . . . 75.319999999999993 112.471 179.988 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 CA-C-O 121.444 0.469 . . . . 62.409999999999997 112.497 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.69 -8.1 22.72 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.703 2.269 . . . . 74.099999999999994 112.323 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.9 25.4 13.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.259 -0.428 . . . . 75.340000000000003 110.915 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.0 -47.95 17.43 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.749 -0.739 . . . . 44.109999999999999 112.442 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 5.5 m -165.98 49.6 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.859 0.362 . . . . 70.439999999999998 110.872 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.2 mtt -138.19 74.79 41.7 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.531 0.681 . . . . 72.219999999999999 110.842 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 -8.2 23.0 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.717 2.278 . . . . 64.230000000000004 112.348 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' TRP . . . . . 0.487 ' CH2' HG21 ' A' ' 153' ' ' VAL . 45.0 p-90 -100.09 -28.25 13.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 75.329999999999998 110.902 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -83.55 102.19 11.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.418 . . . . 74.230000000000004 110.888 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -75.57 -38.65 59.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 64.230000000000004 110.818 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 59.27 18.14 41.38 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.719 -0.753 . . . . 72.230000000000004 112.494 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.96 80.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.68 0.276 . . . . 72.519999999999996 110.871 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.595 HG23 ' HB3' ' A' ' 91' ' ' GLN . 26.5 mm -145.82 145.41 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.321 -0.399 . . . . 74.519999999999996 111.181 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -100.21 176.85 5.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 72.019999999999996 111.156 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -43.29 97.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.22 -0.446 . . . . 71.209999999999994 110.865 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.31 -37.74 78.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 73.209999999999994 110.871 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.595 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.1 OUTLIER -76.51 -38.24 55.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 73.030000000000001 110.847 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.21 -38.47 85.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 63.420000000000002 111.106 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.88 -52.45 50.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 72.329999999999998 110.858 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -33.64 76.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 74.239999999999995 110.862 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 11.7 mt -60.74 -38.0 83.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 74.340000000000003 110.92 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.617 ' CD1' HD23 ' A' ' 105' ' ' LEU . 8.1 mp -105.77 43.18 1.15 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 71.420000000000002 110.891 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -61.39 -59.83 12.37 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.649 0.738 . . . . 74.420000000000002 110.917 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.77 124.2 10.85 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.695 2.263 . . . . 74.329999999999998 112.355 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.79 111.06 2.71 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.694 2.263 . . . . 75.030000000000001 112.273 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -148.99 123.28 9.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 64.430000000000007 110.954 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.687 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -72.97 111.66 8.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 63.030000000000001 111.174 -179.897 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.79 -7.81 6.13 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.786 -0.721 . . . . 63.43 112.47 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -87.4 111.63 21.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.852 0.358 . . . . 62.32 110.98 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -125.33 160.17 29.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 74.400000000000006 110.839 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.617 HD23 ' CD1' ' A' ' 96' ' ' LEU . 1.1 pp -156.09 134.71 11.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.112 -0.495 . . . . 73.319999999999993 110.92 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.518 HG22 HD12 ' A' ' 118' ' ' LEU . 91.9 t -109.52 141.22 25.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.171 -0.468 . . . . 53.409999999999997 111.101 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -153.58 149.94 28.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.474 . . . . 73.530000000000001 110.826 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.81 124.28 10.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.917 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.6 t -57.32 104.93 0.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 61.009999999999998 110.817 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.7 m -68.68 -30.04 68.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 50.229999999999997 111.083 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.656 HD22 HD12 ' B' ' 310' ' ' ILE . 0.1 OUTLIER -74.93 -30.55 61.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 61.350000000000001 110.928 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -139.64 116.09 8.3 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.636 0.731 . . . . 75.25 110.895 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 122.17 8.86 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.676 2.25 . . . . 62.130000000000003 112.349 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.4 -9.73 24.27 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.708 -0.758 . . . . 55.329999999999998 112.54 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -114.53 175.47 5.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.341 . . . . 62.219999999999999 110.871 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -132.57 146.55 51.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 73.329999999999998 110.911 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.445 HG23 ' HE1' ' B' ' 314' ' ' PTR . 3.3 m -116.71 138.84 51.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 74.120000000000005 111.097 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.518 HD12 HG22 ' A' ' 106' ' ' VAL . 0.8 OUTLIER -112.82 115.93 29.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.48 . . . . 73.319999999999993 110.919 179.954 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.4 m -99.87 120.17 39.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.261 -0.427 . . . . 53.25 110.875 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.4 t -121.99 146.97 26.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 65.319999999999993 111.174 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.43 110.45 22.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.229 -0.442 . . . . 75.129999999999995 110.794 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.1 98.05 6.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.092 -0.504 . . . . 75.439999999999998 110.904 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 66.22 28.29 10.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 75.010000000000005 110.86 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.35 -14.91 63.0 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.77 -0.729 . . . . 44.43 112.512 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt -87.58 139.03 30.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.342 . . . . 75.209999999999994 110.986 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.589 ' O ' HD13 ' B' ' 294' ' ' LEU . 11.0 m -99.67 109.68 25.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 71.219999999999999 111.124 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -100.98 130.74 47.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 74.329999999999998 110.826 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -105.9 131.47 53.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 72.049999999999997 110.852 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' TYR . . . . . 0.598 ' HB3' HD13 ' A' ' 140' ' ' ILE . 80.2 m-85 -115.94 115.74 26.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 73.129999999999995 110.892 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -70.55 125.29 26.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.52 . . . . 71.409999999999997 110.865 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.467 HG12 HD11 ' A' ' 140' ' ' ILE . 79.6 mt -107.07 108.9 26.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 60.409999999999997 111.172 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 4.2 ttt -76.27 129.44 36.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.111 -0.495 . . . . 73.200000000000003 110.792 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -111.89 116.65 30.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 74.129999999999995 110.926 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -151.11 135.99 17.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.488 . . . . 72.5 110.846 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.02 35.89 23.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.519999999999996 111.126 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.5 27.16 15.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 70.340000000000003 110.873 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.73 136.07 51.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 64.140000000000001 110.895 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.2 mp -101.52 150.15 23.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.174 -0.466 . . . . 74.099999999999994 110.89 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 53.3 p -167.95 131.81 1.68 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 73.239999999999995 110.895 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.598 HD13 ' HB3' ' A' ' 129' ' ' TYR . 60.7 mt -105.8 -33.5 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 53.340000000000003 111.117 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -85.24 -0.36 54.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 64.319999999999993 110.869 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 60.53 17.72 7.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 62.509999999999998 110.889 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -132.53 -38.55 1.03 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 43.140000000000001 110.932 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.8 t -101.99 104.5 16.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.1 -0.5 . . . . 72.439999999999998 111.166 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -99.87 143.38 30.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 65.25 110.975 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.401 ' CE1' HD12 ' A' ' 152' ' ' LEU . 62.1 m-85 -115.82 174.56 5.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 71.310000000000002 110.909 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -100.87 -3.52 29.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 73.219999999999999 110.888 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -176.51 157.87 1.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 74.400000000000006 110.879 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.3 mp -59.18 -44.08 92.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 62.420000000000002 110.953 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -36.25 36.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 52.240000000000002 110.858 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.21 -45.49 40.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 75.230000000000004 110.941 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.401 HD12 ' CE1' ' A' ' 146' ' ' PHE . 0.4 OUTLIER -55.83 -42.52 75.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 61.530000000000001 110.961 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.516 HG13 HD12 ' A' ' 167' ' ' LEU . 75.5 t -66.6 -43.36 90.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 64.400000000000006 111.13 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -52.97 -37.34 61.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 62.520000000000003 110.915 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -72.3 -47.6 48.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 72.299999999999997 110.81 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.494 ' CD1' HD13 ' A' ' 163' ' ' LEU . 42.9 m-85 -68.35 -15.59 63.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 73.140000000000001 110.943 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.3 m -86.76 -33.98 19.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.079 -0.51 . . . . 71.540000000000006 111.135 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 3.9 m -78.08 -25.37 47.6 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 51.329999999999998 111.076 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -157.5 161.67 38.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.244 -0.434 . . . . 74.219999999999999 110.853 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.65 -54.49 22.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 61.310000000000002 111.092 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 59.81 20.46 9.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 64.150000000000006 110.868 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 109.18 12.19 20.53 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.713 -0.756 . . . . 53.439999999999998 112.397 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.494 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.3 mp -105.89 136.93 44.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.794 0.331 . . . . 75.340000000000003 110.965 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 11.5 t -51.57 -29.69 18.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 72.540000000000006 110.812 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.527 ' HB ' HG22 ' A' ' 101' ' ' THR . 1.9 t -152.67 120.24 6.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 64.010000000000005 111.118 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -50.97 146.1 6.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 75.049999999999997 110.901 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.516 HD12 HG13 ' A' ' 153' ' ' VAL . 7.0 mt -63.48 132.17 50.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 71.230000000000004 110.898 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 168' ' ' ILE . . . . . 0.687 HD12 ' O ' ' A' ' 101' ' ' THR . 23.9 mt -126.97 -51.39 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 73.409999999999997 111.184 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.3 mttm -123.87 119.25 26.83 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.54 0.686 . . . . 74.129999999999995 110.843 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 134.78 28.89 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.742 2.295 . . . . 55.240000000000002 112.362 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.99 84.46 0.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 63.549999999999997 110.898 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.7 m -64.42 129.89 28.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.221 -0.445 . . . . 70.420000000000002 111.153 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.6 mtt . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.24 -0.436 . . . . 71.099999999999994 110.914 179.861 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 CA-C-O 121.419 0.455 . . . . 70.230000000000004 112.485 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.69 167.61 23.85 Favored 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 122.726 2.284 . . . . 64.200000000000003 112.344 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 26.0 mt -63.2 -27.98 69.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.242 -0.435 . . . . 62.299999999999997 110.924 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 101.24 -39.87 2.61 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.813 -0.708 . . . . 52.420000000000002 112.482 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -141.98 148.24 38.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.009 0.433 . . . . 74.200000000000003 110.797 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -157.97 143.08 16.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.061 -0.518 . . . . 74.510000000000005 110.898 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.03 118.13 7.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 73.319999999999993 110.856 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -169.26 108.8 0.44 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.136 -0.483 . . . . 74.400000000000006 110.849 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 1.3 p -96.34 91.36 5.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 72.099999999999994 110.862 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 43.4 p -59.36 -175.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.176 -0.465 . . . . 71.530000000000001 110.816 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 294' ' ' LEU . . . . . 0.589 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.4 OUTLIER -162.17 92.25 0.82 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 71.140000000000001 110.983 -179.974 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 6.2 t -82.95 89.07 6.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 70.140000000000001 110.868 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -79.95 148.42 31.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 75.209999999999994 110.917 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.21 128.53 13.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 73.099999999999994 110.935 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 20.3 m -89.57 162.14 15.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.292 -0.413 . . . . 62.130000000000003 110.888 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -59.33 -19.8 49.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 74.120000000000005 110.857 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -36.7 82.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 63.340000000000003 110.852 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -102.58 -10.56 19.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 63.109999999999999 110.933 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 302' ' ' ASP . . . . . 0.524 ' HB2' HD11 ' B' ' 305' ' ' LEU . 44.7 m-20 -157.58 78.6 3.56 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.662 0.744 . . . . 64.530000000000001 110.937 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.64 -6.7 19.17 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.77 2.314 . . . . 75.120000000000005 112.351 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 15.2 t -93.74 27.54 2.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.213 -0.449 . . . . 65.109999999999999 111.168 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 305' ' ' LEU . . . . . 0.524 HD11 ' HB2' ' B' ' 302' ' ' ASP . 44.0 mt -101.74 138.25 38.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 75.409999999999997 110.955 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 306' ' ' THR . . . . . 0.609 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.8 t -107.52 172.97 6.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 74.519999999999996 111.132 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -50.09 -31.98 14.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.451 . . . . 62.149999999999999 110.967 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 308' ' ' GLU . . . . . 0.462 ' H ' HG23 ' B' ' 306' ' ' THR . 0.6 OUTLIER -66.72 -45.8 77.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.099 -0.501 . . . . 44.450000000000003 110.87 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 309' ' ' GLU . . . . . 0.609 ' HG2' HG22 ' B' ' 306' ' ' THR . 19.3 mm-40 -70.31 -51.67 28.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 52.539999999999999 110.872 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 310' ' ' ILE . . . . . 0.656 HD12 HD22 ' A' ' 111' ' ' ASN . 40.5 mm -55.72 -53.09 41.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 60.240000000000002 111.189 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 35.0 t -63.97 -25.62 68.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 71.099999999999994 110.879 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 312' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' B' ' 308' ' ' GLU . . . -71.16 -9.75 58.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 74.109999999999999 111.144 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -106.53 14.47 27.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 72.299999999999997 110.902 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 314' ' ' PTR . . . . . 0.445 ' HE1' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 86.1 p -113.66 -33.06 5.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.1 -1.409 . . . . 73.230000000000004 110.902 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 65.54 147.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 75.140000000000001 110.857 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 317' ' ' VAL . . . . . 0.404 HG23 ' O ' ' B' ' 317' ' ' VAL . 12.3 m -51.23 116.84 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.084 -0.507 . . . . 74.319999999999993 111.164 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -125.24 75.04 1.42 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 64.530000000000001 110.839 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt -54.6 160.32 2.81 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.616 0.722 . . . . 73.25 110.875 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 111.41 2.81 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.716 2.277 . . . . 73.150000000000006 112.301 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 CA-C-O 119.161 -0.8 . . . . 72.219999999999999 112.527 -179.974 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.723 0.218 . . . . 75.32 112.319 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.444 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 48.9 p-90 -54.86 -26.32 34.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 64.14 110.915 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -89.17 100.55 13.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.27 -0.423 . . . . 71.11 110.885 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 -75.62 -37.06 60.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 75.54 110.834 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 56.24 20.56 29.27 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.703 -0.76 . . . . 65.31 112.501 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.32 79.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.684 0.278 . . . . 64.31 110.857 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.594 HG23 ' HB3' ' A' ' 91' ' ' GLN . 24.4 mm -144.19 144.82 22.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 75.43 111.076 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 p -96.57 177.08 5.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 34.44 111.167 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -66.03 -39.04 89.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.278 -0.419 . . . . 73.55 110.811 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -69.59 -34.75 74.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 71.3 110.893 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.594 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -75.34 -36.63 61.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 64.4 110.899 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.06 -34.0 61.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 64.24 111.028 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.24 -53.4 37.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.234 -0.439 . . . . 61.5 110.855 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.87 -39.17 93.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 74.44 110.916 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 17.3 mt -57.5 -38.44 74.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 74.24 110.913 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.626 HD12 ' CB ' ' A' ' 121' ' ' SER . 2.7 mm? -101.89 43.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 73.34 110.931 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.487 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.93 -60.35 4.48 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.674 0.75 . . . . 75.34 110.982 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.71 123.13 9.82 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.735 2.29 . . . . 62.52 112.341 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 118.08 5.47 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.713 2.275 . . . . 64.34 112.273 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.89 104.4 2.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.445 . . . . 71.11 110.888 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 168' ' ' ILE . 2.6 p -56.82 111.93 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.108 -0.496 . . . . 71.41 111.143 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.85 -8.83 6.09 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.718 -0.753 . . . . 45.24 112.435 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.7 tp -89.74 111.78 22.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.84 0.352 . . . . 62.0 110.901 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -123.75 163.9 20.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 74.32 110.857 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.547 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -159.2 136.99 10.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.213 -0.449 . . . . 73.42 110.918 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.444 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 86.3 t -110.23 137.38 42.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.166 -0.47 . . . . 64.52 111.125 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -150.69 145.58 25.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 73.35 110.912 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.5 124.09 11.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 65.33 110.958 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 t -60.46 114.42 2.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.184 -0.462 . . . . 74.4 110.851 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.465 HG21 ' HB2' ' B' ' 298' ' ' SER . 2.3 m -68.73 -53.17 23.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 63.23 111.143 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.634 ' CG ' HD12 ' B' ' 310' ' ' ILE . 37.1 m-80 -63.49 -29.38 70.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 71.41 110.862 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -125.97 96.11 38.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.667 0.746 . . . . 73.13 110.947 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.66 127.09 14.17 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.69 2.26 . . . . 73.42 112.314 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.4 -15.72 22.37 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.72 -0.752 . . . . 51.01 112.472 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -117.59 179.23 4.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.89 0.376 . . . . 73.15 110.868 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . 0.638 ' CE2' HD21 ' A' ' 149' ' ' LEU . 55.7 m-85 -124.68 162.81 23.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.118 -0.492 . . . . 75.21 110.924 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 89.8 m -134.72 126.45 29.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.122 -0.49 . . . . 65.51 111.136 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.23 119.83 37.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.915 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.5 t -105.94 122.44 46.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 73.04 110.902 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.7 t -122.67 151.01 26.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.268 -0.423 . . . . 71.53 111.121 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.626 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -103.54 111.0 23.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.868 -179.858 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.47 94.59 4.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 71.53 110.881 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 66.23 29.88 9.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 72.4 110.905 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.87 -13.17 63.93 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.72 -0.753 . . . . 72.33 112.492 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -88.01 140.06 29.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.836 0.35 . . . . 73.12 110.906 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.448 ' O ' HG23 ' A' ' 126' ' ' VAL . 8.8 m -101.25 107.88 22.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 63.13 111.111 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -97.05 123.05 40.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 74.32 110.865 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -102.41 125.17 49.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 74.45 110.895 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -113.01 112.56 24.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 72.42 110.924 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.37 132.79 48.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.092 -0.504 . . . . 63.42 110.884 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.523 HG12 HD11 ' A' ' 140' ' ' ILE . 29.3 mt -113.19 110.1 30.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.224 -0.444 . . . . 74.44 111.18 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.04 128.56 34.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 62.1 110.904 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.448 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -115.42 101.37 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.411 . . . . 75.01 110.888 -179.863 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -136.49 142.57 43.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.479 . . . . 74.21 110.848 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.14 35.96 25.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 73.01 111.169 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.28 29.6 19.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 73.03 110.825 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -136.23 142.3 44.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.08 -0.509 . . . . 74.05 110.905 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.448 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 4.1 mp -103.86 150.06 24.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.25 -0.432 . . . . 70.04 110.9 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 33.8 t -167.37 140.45 3.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.161 -0.472 . . . . 74.22 110.846 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.596 HG22 HG13 ' B' ' 317' ' ' VAL . 58.9 mt -115.7 -28.76 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.143 -0.481 . . . . 60.3 111.125 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.59 ' HA ' HG21 ' B' ' 317' ' ' VAL . 6.1 p30 -95.28 -1.74 50.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 75.14 110.875 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 61.57 17.03 8.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 64.4 110.862 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -127.49 -33.99 2.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 35.43 110.882 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -112.21 104.58 17.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.112 -0.494 . . . . 63.32 111.09 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -97.79 143.98 27.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 71.54 111.01 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . 0.529 ' CD1' HD12 ' A' ' 152' ' ' LEU . 51.3 m-85 -118.55 178.07 4.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 71.2 110.875 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.55 -15.44 17.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 71.43 110.859 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -165.39 172.27 12.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.175 -0.466 . . . . 71.02 110.93 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.638 HD21 ' CE2' ' A' ' 116' ' ' TYR . 0.7 OUTLIER -74.63 -24.78 58.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.168 -0.469 . . . . 75.25 110.909 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.3 tmm? -61.54 -57.09 13.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.271 -0.422 . . . . 61.44 110.903 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.65 -36.1 82.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 63.31 110.94 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.529 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.69 -48.27 75.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.439 . . . . 73.05 110.92 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.52 HG13 HD12 ' A' ' 167' ' ' LEU . 73.6 t -64.84 -37.43 80.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 72.51 111.19 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -56.1 -38.12 70.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 74.21 110.887 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.09 -44.33 63.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.47 . . . . 75.5 110.879 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -71.1 -16.14 62.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 62.52 110.925 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 95.4 m -87.02 -33.3 19.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.501 . . . . 72.34 111.123 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.4 t -80.52 -24.29 39.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 63.41 111.153 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -157.47 155.01 29.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 71.13 110.845 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.18 -57.46 8.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 73.32 111.102 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 60.01 20.75 9.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 70.01 110.866 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.78 17.24 7.54 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.756 -0.735 . . . . 75.22 112.507 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 9.7 mp -111.18 139.13 46.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.833 0.349 . . . . 72.03 110.935 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 38.4 t -51.37 -31.76 23.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 55.41 110.904 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 5.3 t -156.02 124.42 5.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 33.14 111.174 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -51.43 146.87 6.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 73.13 110.78 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.52 HD12 HG13 ' A' ' 153' ' ' VAL . 7.7 mt -65.74 138.45 57.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.144 -0.48 . . . . 73.34 110.901 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 101' ' ' THR . 26.4 mt -127.24 -51.31 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.168 -0.469 . . . . 73.21 111.132 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 1.8 mmtp -129.2 121.98 20.87 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.605 0.717 . . . . 71.4 110.902 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 138.24 37.6 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.718 2.278 . . . . 62.42 112.3 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.46 83.36 0.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 65.05 110.88 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.5 m -64.46 134.91 28.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 63.43 111.148 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.5 ptm . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 51.54 110.853 179.943 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.437 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.812 0.339 . . . . 62.1 110.944 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.6 t -96.2 88.95 4.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 53.23 110.882 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -71.47 147.09 48.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 51.31 110.869 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.06 129.48 21.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.11 -0.495 . . . . 72.11 110.869 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . 0.465 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -93.86 161.29 14.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 33.05 110.851 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -61.33 -17.74 55.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 74.15 110.875 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -36.99 84.62 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.132 -0.485 . . . . 73.44 110.914 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -100.33 -20.61 15.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 74.34 110.933 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.514 ' HB2' HD11 ' B' ' 305' ' ' LEU . 23.8 m-20 -147.82 79.07 9.52 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.619 0.724 . . . . 63.54 110.825 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -6.54 18.85 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.678 2.252 . . . . 72.12 112.35 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.3 t -94.05 27.47 2.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.23 -0.441 . . . . 62.41 111.129 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' B' ' 302' ' ' ASP . 47.6 mt -100.64 136.94 39.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.247 -0.433 . . . . 72.4 110.875 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.607 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.2 t -108.96 172.34 6.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 62.41 111.158 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -48.98 -34.16 12.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.2 -0.455 . . . . 71.0 110.93 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . 0.418 ' H ' HG23 ' B' ' 306' ' ' THR . 2.7 mt-10 -64.28 -45.09 89.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 72.32 110.895 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.607 ' HG2' HG22 ' B' ' 306' ' ' THR . 10.4 mm-40 -74.31 -50.21 19.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.49 . . . . 71.14 110.847 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.634 HD12 ' CG ' ' A' ' 111' ' ' ASN . 40.6 mm -55.69 -53.05 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 62.42 111.131 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 25.0 m -62.74 -32.48 73.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 54.11 110.851 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -62.88 -16.56 59.27 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.146 -0.479 . . . . 75.15 111.145 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 53.34 110.905 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.846 0.355 . . . . 74.01 110.864 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 3.1 m 63.88 158.03 0.08 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 61.23 110.876 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.596 HG13 HG22 ' A' ' 140' ' ' ILE . 4.7 m -51.61 123.21 2.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.145 -0.479 . . . . 63.44 111.196 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -137.87 77.67 1.64 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 73.2 110.852 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp . . . . . 0 C--N 1.329 -0.293 0 CA-C-O 121.534 0.683 . . . . 75.54 110.957 179.909 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.153 0 CA-C-O 120.737 0.224 . . . . 53.41 112.316 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.415 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 38.0 p-90 -102.76 -30.13 11.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 75.43 110.871 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -87.42 97.22 10.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 75.42 110.908 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.77 -37.48 59.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 72.02 110.894 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.7 25.94 56.57 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.704 -0.76 . . . . 54.24 112.474 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.26 67.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.726 0.298 . . . . 72.21 110.91 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 15.5 mm -128.41 144.12 38.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 73.21 111.111 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.459 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -94.87 171.23 8.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.153 -0.476 . . . . 74.33 111.198 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.459 ' H ' HG22 ' A' ' 88' ' ' THR . 7.1 ppt_? -62.03 -39.08 91.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 74.45 110.829 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -75.15 -32.8 61.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 55.54 110.952 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -69.97 -41.38 74.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.161 -0.472 . . . . 73.22 110.888 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.606 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -74.26 -36.55 63.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 71.34 111.051 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.64 -53.21 60.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 75.32 110.887 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.45 -34.08 76.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 71.3 110.884 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.606 HD12 ' HA ' ' A' ' 92' ' ' ALA . 9.5 mt -54.88 -38.42 67.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 71.14 110.938 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.775 HD21 HD23 ' A' ' 105' ' ' LEU . 3.9 mm? -100.27 43.57 1.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 70.5 110.894 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.514 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.38 -59.47 4.91 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.712 0.768 . . . . 72.43 110.902 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 52.7 Cg_endo -69.78 123.74 10.39 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.74 2.294 . . . . 73.11 112.304 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 115.63 4.19 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.639 2.226 . . . . 73.2 112.3 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -155.34 121.03 5.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.254 -0.43 . . . . 62.24 110.871 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.682 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.8 OUTLIER -72.39 111.74 7.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.097 -0.501 . . . . 64.03 111.128 -179.906 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.28 -4.32 6.76 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.696 -0.764 . . . . 51.24 112.481 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.544 HD12 ' O ' ' A' ' 169' ' ' LYS . 3.8 tp -90.24 120.92 31.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.908 0.385 . . . . 75.23 110.895 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.463 ' HB3' HD22 ' A' ' 167' ' ' LEU . 23.7 p90 -133.05 175.94 8.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.118 -0.492 . . . . 65.12 110.919 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.775 HD23 HD21 ' A' ' 96' ' ' LEU . 0.9 OUTLIER -169.47 134.27 1.43 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 74.25 110.863 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.415 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 84.7 t -110.93 131.4 62.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 34.3 111.161 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.66 150.81 36.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 74.5 110.863 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -57.5 124.08 17.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 74.53 110.927 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.5 m -57.94 117.1 3.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 72.31 110.868 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.9 m -69.01 -56.17 8.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 64.32 111.071 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -71.97 -26.76 62.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 63.02 110.913 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -108.42 90.63 7.31 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.655 0.74 . . . . 62.13 110.922 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 113.56 3.41 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.71 2.273 . . . . 73.03 112.339 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.44 2.62 24.4 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.704 -0.76 . . . . 73.24 112.512 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -130.78 -172.62 2.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.82 0.343 . . . . 71.11 110.853 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -140.52 145.23 36.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.882 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 31.6 m -108.95 128.22 54.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 64.32 111.12 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.488 HD23 ' HB2' ' A' ' 129' ' ' TYR . 0.4 OUTLIER -110.86 104.7 13.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 72.22 110.916 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.3 m -87.21 153.91 21.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.185 -0.461 . . . . 64.04 110.843 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.633 HG21 HD12 ' A' ' 163' ' ' LEU . 12.8 t -146.58 142.66 20.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 64.12 111.192 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.62 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.3 OUTLIER -92.13 111.29 22.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 64.55 110.803 -179.803 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -123.23 93.55 3.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 75.44 110.905 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 67.5 29.27 7.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 71.33 110.837 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.68 -19.05 56.18 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.741 -0.742 . . . . 52.1 112.464 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -87.44 136.68 32.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.851 0.358 . . . . 73.15 110.891 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.52 ' O ' HD13 ' B' ' 294' ' ' LEU . 4.1 p -97.26 106.73 18.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 74.43 111.105 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -91.95 120.19 32.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.123 -0.49 . . . . 64.4 110.924 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -87.79 124.72 33.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 72.43 110.878 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.686 ' CZ ' HD13 ' A' ' 163' ' ' LEU . 57.0 m-85 -114.14 106.8 14.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 75.4 110.919 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -64.06 141.28 58.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 73.31 110.905 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.433 HG21 HD23 ' A' ' 138' ' ' LEU . 61.9 mt -123.25 111.25 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 64.43 111.13 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.32 125.07 31.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 65.3 110.862 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.492 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -111.77 98.27 7.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 75.31 110.947 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -130.83 142.56 50.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 44.44 110.872 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.2 35.96 25.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 73.14 111.182 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.44 29.32 18.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.473 . . . . 62.31 110.861 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mtmm -134.1 139.93 46.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 65.34 110.91 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.492 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 4.8 mp -102.01 149.21 24.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.271 -0.422 . . . . 70.34 110.934 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.2 p -165.69 140.57 4.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 71.11 110.901 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.532 HG22 HG13 ' B' ' 317' ' ' VAL . 50.1 mt -115.56 -32.5 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 73.12 111.155 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.561 ' HA ' HG21 ' B' ' 317' ' ' VAL . 40.3 t0 -89.64 1.14 56.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 75.42 110.918 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 60.53 17.81 7.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 74.55 110.865 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -132.43 -38.59 1.04 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 73.12 110.88 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.48 104.6 16.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 71.53 111.104 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -99.95 144.58 28.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 73.12 110.933 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . 0.482 ' CD1' HD12 ' A' ' 152' ' ' LEU . 57.7 m-85 -117.89 177.77 4.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 74.41 110.896 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.65 -15.31 17.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 74.32 110.919 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -166.06 172.13 11.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 75.5 110.933 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.6 -24.45 58.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.202 -0.454 . . . . 73.14 110.943 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.88 -56.94 14.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 71.11 110.904 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.95 -35.33 80.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 65.14 110.917 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.482 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.59 -52.4 63.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.463 . . . . 62.24 110.924 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.696 HG13 HD12 ' A' ' 167' ' ' LEU . 85.3 t -62.77 -36.63 76.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 44.03 111.099 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -55.51 -39.09 70.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 41.02 110.856 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -72.08 -44.18 63.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 64.54 110.857 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.405 ' CD1' HD23 ' A' ' 163' ' ' LEU . 30.2 m-85 -67.91 -21.94 65.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.445 . . . . 50.12 110.929 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.529 HG23 ' O ' ' A' ' 167' ' ' LEU . 63.0 m -84.57 -30.2 25.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.081 -0.508 . . . . 71.1 111.172 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 93.5 m -79.84 -24.01 41.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.191 -0.459 . . . . 75.42 111.18 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -163.15 159.54 23.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 72.33 110.835 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.25 -57.99 7.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 73.23 111.047 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 57.04 24.18 9.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.212 -0.449 . . . . 72.33 110.891 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 112.75 0.89 25.86 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.707 -0.759 . . . . 75.13 112.471 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.686 HD13 ' CZ ' ' A' ' 129' ' ' TYR . 4.0 mm? -95.71 136.22 36.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.923 0.392 . . . . 41.44 110.922 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 49.3 t -51.82 -28.94 17.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.15 -0.477 . . . . 64.24 110.908 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.2 t -156.97 123.46 4.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.123 -0.489 . . . . 64.5 111.102 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -51.49 139.99 18.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.231 -0.44 . . . . 70.51 110.892 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.696 HD12 HG13 ' A' ' 153' ' ' VAL . 8.6 mt -62.32 135.81 57.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 73.42 110.946 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.682 HD12 ' O ' ' A' ' 101' ' ' THR . 29.3 mt -127.05 -51.4 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.431 . . . . 75.13 111.18 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . 0.544 ' O ' HD12 ' A' ' 103' ' ' LEU . 21.3 mttt -126.88 118.29 22.34 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.574 0.702 . . . . 74.24 110.881 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 138.15 37.15 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.757 2.305 . . . . 73.41 112.373 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . 0.409 ' HD3' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -68.18 84.9 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 55.22 110.913 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 33.9 m -64.34 138.8 22.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 73.43 111.174 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.1 ptm . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 74.05 110.854 179.892 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.866 0.365 . . . . 74.25 110.919 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 28.4 t -92.47 88.65 6.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 73.34 110.856 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -71.62 147.69 47.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.47 . . . . 70.02 110.934 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . 0.4 ' HB2' ' HE1' ' B' ' 313' ' ' MET . 1.5 mtpp -154.0 129.46 9.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 72.43 110.921 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.61 175.3 5.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 71.43 110.887 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 41.8 mtt180 -63.7 -16.0 59.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 75.41 110.913 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.04 -42.12 98.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 74.03 110.903 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -103.12 -15.55 16.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 74.32 110.925 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.528 ' HB2' HD11 ' B' ' 305' ' ' LEU . 5.4 m-20 -151.37 78.16 7.13 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.551 0.691 . . . . 75.11 110.801 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 -6.28 18.25 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.606 2.204 . . . . 74.54 112.326 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.7 t -93.4 27.23 2.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 70.33 111.096 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.528 HD11 ' HB2' ' B' ' 302' ' ' ASP . 36.8 mt -103.48 137.81 41.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.217 -0.447 . . . . 72.03 110.888 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.606 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -103.48 173.52 6.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 72.13 111.118 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.87 -35.23 22.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 74.31 110.838 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . 0.409 ' H ' HG23 ' B' ' 306' ' ' THR . 6.0 tt0 -63.28 -48.32 78.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.187 -0.461 . . . . 62.25 110.927 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.606 ' HG2' HG22 ' B' ' 306' ' ' THR . 2.9 mm-40 -66.43 -52.27 48.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 74.11 110.897 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 45.8 mm -56.82 -45.75 83.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 60.54 111.12 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 32.6 p -72.5 -15.94 61.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 71.35 110.904 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -81.98 1.75 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.119 -0.491 . . . . 74.34 111.115 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . 0.4 ' HE1' ' HB2' ' B' ' 297' ' ' LYS . 2.3 mtt . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 72.4 110.833 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 27.3 t . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.897 0.379 . . . . 73.44 110.935 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 6.0 t 65.06 150.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.089 -0.505 . . . . 75.31 110.9 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.561 HG21 ' HA ' ' A' ' 141' ' ' ASP . 4.3 m -51.64 123.07 2.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.094 -0.503 . . . . 73.25 111.121 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -134.49 75.0 1.56 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.485 . . . . 75.12 110.875 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.1 mtmp? . . . . . 0 C--N 1.329 -0.299 0 CA-C-O 121.571 0.7 . . . . 73.13 110.857 179.911 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.465 -0.162 0 CA-C-O 120.763 0.235 . . . . 72.13 112.412 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.451 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 49.5 p-90 -54.89 -25.68 30.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 63.34 110.921 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -90.36 99.22 12.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 73.31 110.881 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -75.89 -40.69 53.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.119 -0.491 . . . . 72.35 110.778 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.83 24.84 54.91 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.732 -0.747 . . . . 70.13 112.512 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.79 65.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.815 0.34 . . . . 62.11 110.93 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.475 ' CG2' ' HB2' ' A' ' 92' ' ' ALA . 12.3 mm -129.73 144.21 38.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.145 -0.48 . . . . 63.12 111.081 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.456 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -99.77 177.17 5.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 75.1 111.175 179.878 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.456 ' H ' HG22 ' A' ' 88' ' ' THR . 2.3 ppt_? -64.59 -40.84 96.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 73.23 110.88 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -71.53 -34.74 70.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 74.42 110.869 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -73.29 -42.27 62.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 61.04 110.882 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 87' ' ' ILE . . . -74.17 -33.81 63.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 74.4 111.098 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.496 ' OE2' HG21 ' A' ' 126' ' ' VAL . 24.0 mm-40 -62.2 -53.25 57.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 53.44 110.857 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -35.01 79.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.843 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 12.9 mt -59.09 -36.19 74.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.917 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.635 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -104.43 43.48 1.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 61.31 110.9 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.56 -59.98 5.22 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.675 0.75 . . . . 65.45 110.94 -179.999 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.5 Cg_endo -69.86 123.51 10.14 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.641 2.227 . . . . 74.53 112.311 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 117.35 5.03 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.608 2.206 . . . . 62.13 112.379 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -154.84 115.2 3.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 65.1 110.863 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.643 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.2 OUTLIER -66.53 111.91 3.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 63.11 111.2 -179.908 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.5 -6.47 6.26 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.695 -0.764 . . . . 64.01 112.452 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.6 tp -90.47 111.75 23.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.83 0.347 . . . . 63.02 110.936 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.501 ' HB3' HD22 ' A' ' 167' ' ' LEU . 22.3 p90 -124.43 163.66 21.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.462 . . . . 71.43 110.866 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.587 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -159.49 137.11 9.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.478 . . . . 74.31 110.902 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.451 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 92.2 t -110.22 137.89 40.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 75.13 111.157 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.71 145.76 26.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.148 -0.478 . . . . 65.02 110.938 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -51.9 124.22 12.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 61.15 110.881 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.7 m -58.31 110.96 1.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 61.15 110.81 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.502 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.8 m -68.82 -54.67 14.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 72.1 111.161 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.625 ' CG ' HD12 ' B' ' 310' ' ' ILE . 34.2 m-80 -63.72 -27.92 69.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 72.31 110.859 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.418 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 5.2 m-85 -123.14 95.28 46.05 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.659 0.742 . . . . 74.24 110.898 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.9 Cg_endo -69.7 122.64 9.33 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.672 2.248 . . . . 73.33 112.364 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.49 -2.32 24.94 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.745 -0.741 . . . . 55.34 112.476 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -131.09 -175.94 3.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.856 0.36 . . . . 73.54 110.822 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -131.54 164.57 25.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.915 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.8 m -135.93 139.48 43.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 53.43 111.134 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.448 HD23 ' CD1' ' A' ' 129' ' ' TYR . 0.4 OUTLIER -109.98 117.18 33.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.199 -0.455 . . . . 75.13 110.95 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.3 m -101.52 123.93 46.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 71.02 110.896 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.3 t -123.12 151.72 27.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 73.34 111.136 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.635 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -101.09 111.59 23.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 73.43 110.882 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.43 91.04 3.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.13 -0.486 . . . . 72.15 110.943 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 67.12 30.72 7.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 74.35 110.826 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.95 -14.83 62.4 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.822 -0.704 . . . . 31.1 112.505 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.3 ptpt -88.11 140.18 29.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.813 0.34 . . . . 64.14 110.885 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.519 ' O ' HD22 ' B' ' 294' ' ' LEU . 8.6 m -99.94 108.9 23.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.253 -0.431 . . . . 63.13 111.085 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -95.9 121.8 38.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 71.55 110.929 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -99.73 124.67 45.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 65.54 110.892 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.448 ' CD1' HD23 ' A' ' 118' ' ' LEU . 74.1 m-85 -111.13 117.23 32.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 74.54 110.92 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -67.64 132.29 47.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 71.35 110.871 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.457 ' CG2' HD23 ' A' ' 138' ' ' LEU . 55.1 mt -113.56 107.57 23.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 74.12 111.116 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.9 ttm -83.92 122.56 28.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.19 -0.459 . . . . 62.33 110.902 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.448 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -111.29 99.4 8.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 53.32 110.913 -179.845 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -133.44 142.54 48.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 75.33 110.927 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 57.21 35.96 26.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.298 -0.41 . . . . 75.54 111.126 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.7 t 60.85 28.12 17.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 61.32 110.91 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.12 140.67 45.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 75.23 110.902 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.457 HD23 ' CG2' ' A' ' 131' ' ' ILE . 4.0 mp -102.2 147.65 26.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 65.53 110.911 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.95 137.66 5.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 53.04 110.828 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.502 HG22 HG13 ' B' ' 317' ' ' VAL . 51.0 mt -113.35 -31.93 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 74.24 111.152 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.564 ' HA ' HG21 ' B' ' 317' ' ' VAL . 40.7 t0 -90.52 1.2 56.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 71.55 110.894 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 60.62 17.81 7.81 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 60.5 110.899 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -132.43 -38.7 1.04 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 65.42 110.912 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.27 104.64 16.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 44.23 111.141 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -100.0 143.26 30.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 73.34 110.86 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . 0.509 ' CD1' HD12 ' A' ' 152' ' ' LEU . 60.3 m-85 -117.83 175.14 5.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 73.1 110.87 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.63 -1.91 34.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.505 . . . . 71.23 110.88 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.425 ' C ' HD13 ' A' ' 138' ' ' LEU . 0.8 OUTLIER -179.31 172.23 1.22 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 71.43 110.884 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.411 ' O ' HG23 ' A' ' 153' ' ' VAL . 0.7 OUTLIER -75.24 -28.18 59.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 65.35 110.925 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.0 ttt -58.03 -57.21 13.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 72.25 110.843 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -65.69 -37.31 86.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 73.44 110.944 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.509 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.4 OUTLIER -55.43 -46.91 76.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 63.32 110.949 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.434 HG13 ' CD1' ' A' ' 167' ' ' LEU . 69.3 t -64.6 -39.47 85.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 75.44 111.152 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -54.83 -38.72 67.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.103 -0.498 . . . . 73.3 110.949 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.31 -45.43 63.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 74.13 110.887 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.426 ' CD1' HD13 ' A' ' 163' ' ' LEU . 31.9 m-85 -67.22 -21.98 65.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 75.45 110.935 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.424 HG23 ' O ' ' A' ' 167' ' ' LEU . 58.7 m -84.15 -29.95 26.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 73.33 111.139 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 86.4 m -78.13 -27.0 48.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.203 -0.453 . . . . 61.52 111.121 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -164.71 155.65 14.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.245 -0.434 . . . . 75.51 110.838 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . 0.532 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -51.35 -58.2 6.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.135 -0.484 . . . . 75.11 111.092 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 52.51 28.97 6.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 72.25 110.873 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 121.89 -2.54 10.88 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.712 -0.756 . . . . 74.42 112.514 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.532 ' O ' ' HB1' ' A' ' 160' ' ' ALA . 9.6 mp -101.62 136.45 41.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.786 0.327 . . . . 72.12 110.969 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . 0.473 ' SG ' HG22 ' A' ' 165' ' ' THR . 19.5 p -54.42 -26.72 32.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.169 -0.469 . . . . 72.14 110.894 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.473 HG22 ' SG ' ' A' ' 164' ' ' CYS . 9.0 t -157.31 125.09 5.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.103 -0.499 . . . . 70.1 111.126 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -51.96 164.99 0.23 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 73.34 110.845 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.501 HD22 ' HB3' ' A' ' 104' ' ' PHE . 11.5 mt -84.58 138.72 32.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 71.4 110.924 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.643 HD12 ' O ' ' A' ' 101' ' ' THR . 27.7 mt -127.22 -51.22 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 75.03 111.106 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -128.58 121.22 21.11 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.533 0.682 . . . . 41.32 110.935 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.84 136.99 34.19 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.633 2.222 . . . . 71.14 112.31 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.41 83.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 74.3 110.88 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 26.9 m -64.64 133.1 30.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 45.41 111.136 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 37.6 mtm . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 72.03 110.822 179.929 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.519 HD22 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.799 0.333 . . . . 75.03 110.876 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.25 88.83 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 63.43 110.837 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -72.61 146.9 46.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 75.25 110.904 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -140.82 129.23 22.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.081 -0.509 . . . . 70.51 110.822 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . 0.502 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -92.31 156.21 17.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 55.43 110.856 -179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -59.17 -19.37 44.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.092 -0.504 . . . . 72.11 110.843 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.7 -39.5 88.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 74.42 110.867 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -96.2 -20.16 18.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.46 . . . . 71.43 111.017 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.476 ' HB2' HD11 ' B' ' 305' ' ' LEU . 41.9 m-20 -147.34 77.77 10.51 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.596 0.712 . . . . 72.31 110.888 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -6.37 18.41 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.716 2.277 . . . . 71.24 112.349 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.2 t -93.79 27.45 2.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.249 -0.432 . . . . 65.04 111.167 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.476 HD11 ' HB2' ' B' ' 302' ' ' ASP . 42.1 mt -100.56 136.79 39.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 75.34 110.979 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.621 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -106.45 173.76 6.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 62.34 111.083 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -49.92 -37.45 31.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 62.23 110.89 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -60.87 -50.68 72.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 75.11 110.877 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.621 ' HG2' HG22 ' B' ' 306' ' ' THR . 16.6 mm-40 -66.21 -52.04 51.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 71.34 110.907 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.625 HD12 ' CG ' ' A' ' 111' ' ' ASN . 44.7 mm -56.04 -53.5 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 73.44 111.092 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 20.1 m -64.18 -19.05 65.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 73.44 110.832 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.28 3.79 26.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.101 -0.5 . . . . 35.05 111.134 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 72.4 110.818 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.892 0.377 . . . . 72.11 110.88 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.34 155.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 70.42 110.866 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.564 HG21 ' HA ' ' A' ' 141' ' ' ASP . 4.3 m -51.74 120.54 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 62.21 111.145 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -135.43 74.66 1.52 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 75.4 110.955 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.596 0.712 . . . . 63.34 110.922 179.972 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.133 0 CA-C-O 120.773 0.239 . . . . 51.41 112.285 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 46.9 p-90 -54.44 -27.1 34.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.261 -0.427 . . . . 64.44 110.915 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -86.52 100.83 12.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 73.32 110.924 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -75.81 -39.42 56.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 73.34 110.894 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.28 22.7 45.06 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.787 -0.72 . . . . 53.21 112.495 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 pttt 179.01 68.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.717 0.294 . . . . 73.02 110.872 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 mm -133.7 144.21 36.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 74.21 111.138 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.454 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -101.23 177.03 5.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.472 . . . . 73.41 111.176 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.454 ' H ' HG22 ' A' ' 88' ' ' THR . 0.0 OUTLIER -63.76 -43.57 96.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 74.01 110.84 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.44 -32.52 72.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 74.14 110.897 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -75.61 -43.16 49.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.128 -0.487 . . . . 71.41 110.934 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.83 -33.57 64.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 63.42 111.129 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -63.34 -53.29 54.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 61.32 110.883 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.08 -34.92 79.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 73.44 110.849 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 13.5 mt -60.56 -35.78 76.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 73.54 110.974 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.674 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -102.32 43.55 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 64.4 110.861 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.24 -60.04 5.48 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.673 0.749 . . . . 73.13 110.917 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.82 123.17 9.82 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.727 2.284 . . . . 74.5 112.345 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 117.82 5.31 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.63 2.22 . . . . 74.25 112.396 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -154.81 104.79 2.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 71.41 110.916 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.641 ' O ' HD12 ' A' ' 168' ' ' ILE . 33.2 p -57.98 111.92 1.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 33.32 111.165 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.05 -7.2 6.07 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.772 -0.728 . . . . 41.44 112.522 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.02 113.61 25.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.886 0.375 . . . . 63.22 110.899 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 27.0 p90 -125.22 165.2 18.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 75.1 110.853 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.621 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -161.54 137.28 7.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 64.13 110.939 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 89.0 t -110.19 142.88 21.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 74.12 111.132 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.96 148.83 25.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 73.35 110.855 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -52.08 124.21 12.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 73.35 110.916 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.2 m -59.81 117.31 4.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 55.11 110.928 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.59 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.3 m -69.12 -56.42 7.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.482 . . . . 50.22 111.146 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.456 ' H ' ' ND2' ' A' ' 111' ' ' ASN . 0.9 OUTLIER -70.96 -24.0 62.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 75.01 110.899 179.991 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -113.28 93.51 26.72 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.727 0.775 . . . . 74.32 110.94 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 111.07 2.7 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.721 2.28 . . . . 71.33 112.38 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.6 0.14 24.7 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.768 -0.73 . . . . 24.13 112.53 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -125.29 -175.88 3.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.797 0.332 . . . . 73.22 110.867 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -137.38 148.0 45.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 70.51 110.916 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 25.4 m -115.51 141.68 47.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.108 -0.496 . . . . 73.41 111.156 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.412 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.4 OUTLIER -111.79 116.56 30.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 73.2 110.911 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.1 t -100.65 129.16 46.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.911 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.412 ' CG2' HD21 ' A' ' 118' ' ' LEU . 17.3 t -130.03 149.11 33.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 73.31 111.066 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.674 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -101.07 111.03 23.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 61.03 110.852 -179.784 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.47 93.5 4.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 74.22 110.901 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 66.14 30.78 9.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 73.42 110.839 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.6 -14.3 63.29 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.73 -0.748 . . . . 74.22 112.536 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -88.08 147.5 24.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.756 0.312 . . . . 72.22 110.926 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.425 ' O ' HG23 ' A' ' 126' ' ' VAL . 7.0 m -105.51 109.22 27.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 62.43 111.14 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -96.94 113.7 25.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 72.33 110.865 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -91.13 124.65 35.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 74.24 110.815 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.638 ' CZ ' HD13 ' A' ' 163' ' ' LEU . 48.5 m-85 -114.08 116.19 28.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.218 -0.446 . . . . 72.31 110.909 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.48 137.07 46.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.102 -0.499 . . . . 70.45 110.872 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 26.0 mt -119.7 109.62 26.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 74.14 111.113 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -81.3 124.72 29.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.272 -0.422 . . . . 64.33 110.902 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.494 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -111.67 98.29 7.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.307 -0.406 . . . . 72.53 110.937 -179.875 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -132.06 142.57 49.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 72.4 110.897 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.18 35.97 26.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 74.44 111.073 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.38 26.6 16.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 71.4 110.84 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -131.93 139.14 48.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 72.04 110.894 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.494 HD21 ' CE2' ' A' ' 133' ' ' TYR . 3.7 mp -102.42 149.86 23.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 73.3 110.922 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 29.2 t -166.19 140.96 4.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 61.12 110.814 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.508 HG22 HG13 ' B' ' 317' ' ' VAL . 52.2 mt -115.59 -32.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.048 -0.524 . . . . 74.24 111.173 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.526 ' HA ' HG21 ' B' ' 317' ' ' VAL . 38.7 t0 -89.7 1.05 56.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 72.12 110.92 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 60.41 18.18 7.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 71.0 110.795 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -132.29 -38.43 1.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 72.21 110.88 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.4 t -103.06 104.54 16.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 44.34 111.132 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -99.88 144.69 28.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 62.01 110.933 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . 0.531 ' CD1' HD12 ' A' ' 152' ' ' LEU . 54.8 m-85 -118.64 178.42 4.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 74.14 110.924 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -100.19 -16.22 17.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 75.23 110.917 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -164.81 171.65 13.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.111 -0.495 . . . . 71.23 110.874 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.459 ' H ' HD12 ' A' ' 149' ' ' LEU . 0.7 OUTLIER -74.63 -22.37 58.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 64.21 110.949 179.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.2 ttp -63.67 -56.96 11.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 73.43 110.876 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.82 -36.3 83.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.289 -0.414 . . . . 74.32 110.885 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.531 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.68 -47.58 76.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.198 -0.455 . . . . 73.53 110.916 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.478 HG13 ' CD1' ' A' ' 167' ' ' LEU . 70.7 t -65.29 -37.49 80.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 73.13 111.14 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -55.53 -38.76 69.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.134 -0.485 . . . . 64.41 110.926 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -45.29 61.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.891 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.415 ' CD1' HD23 ' A' ' 163' ' ' LEU . 27.9 m-85 -67.5 -22.17 65.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 74.14 110.962 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 63.6 m -84.32 -29.62 26.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.105 -0.498 . . . . 43.01 111.088 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 92.6 m -78.13 -26.94 48.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 75.21 111.15 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.09 160.8 30.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 62.24 110.85 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.81 -58.28 6.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 63.33 111.068 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 6.0 t0 57.12 23.58 8.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 73.13 110.947 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.29 -0.64 25.2 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.721 -0.752 . . . . 32.42 112.498 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.638 HD13 ' CZ ' ' A' ' 129' ' ' TYR . 4.0 mm? -93.28 140.08 29.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.942 0.401 . . . . 60.44 110.855 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 44.3 t -51.33 -30.37 18.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 52.42 110.871 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.8 t -158.96 127.34 5.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 70.33 111.137 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -51.35 140.59 16.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 71.4 110.868 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.478 ' CD1' HG13 ' A' ' 153' ' ' VAL . 8.6 mt -62.39 139.51 58.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 54.13 110.919 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.641 HD12 ' O ' ' A' ' 101' ' ' THR . 26.6 mt -126.94 -51.3 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.284 -0.416 . . . . 71.21 111.164 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -131.03 123.35 19.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.585 0.707 . . . . 73.11 110.951 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 135.43 30.44 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.711 2.274 . . . . 61.53 112.331 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.8 83.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.434 . . . . 75.22 110.886 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.7 m -64.32 136.8 25.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.296 -0.411 . . . . 72.12 111.165 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 70.11 110.824 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 1.7 mt . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.789 0.328 . . . . 61.41 110.868 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 40.0 t -84.83 88.68 7.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 72.5 110.832 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -76.08 149.61 37.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 74.35 110.972 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.57 129.17 17.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.117 -0.492 . . . . 55.24 110.932 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . 0.59 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -94.13 163.05 13.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.286 -0.416 . . . . 63.22 110.862 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 10.6 mtt180 -63.8 -15.42 58.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 72.31 110.853 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -37.94 84.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 72.42 110.876 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -96.98 -14.96 21.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.107 -0.497 . . . . 65.33 110.794 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.544 ' HB2' HD11 ' B' ' 305' ' ' LEU . 14.9 m-20 -156.39 80.75 3.7 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.577 0.703 . . . . 75.14 110.85 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -6.01 17.6 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.693 2.262 . . . . 65.04 112.341 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.2 t -93.61 27.26 2.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 72.23 111.188 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' B' ' 302' ' ' ASP . 34.7 mt -103.9 136.89 42.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 72.24 110.875 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.579 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.1 t -102.16 170.05 8.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.164 -0.471 . . . . 72.4 111.139 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -49.67 -33.89 16.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 64.22 110.919 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -62.5 -48.44 79.54 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.162 -0.472 . . . . 62.33 110.9 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.579 ' HG2' HG22 ' B' ' 306' ' ' THR . 7.9 mm-40 -65.14 -51.72 59.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 72.22 110.92 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 27.4 mm -58.59 -53.77 42.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 75.15 111.089 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 26.8 t -58.01 -24.3 57.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 75.24 110.84 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -74.55 -5.67 44.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 51.25 111.069 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.256 -0.429 . . . . 72.2 110.879 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 3.9 t . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.791 0.329 . . . . 62.15 110.795 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.88 152.82 0.05 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 50.32 110.915 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.526 HG21 ' HA ' ' A' ' 141' ' ' ASP . 4.5 m -54.19 122.28 3.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.468 . . . . 71.13 111.096 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -132.95 74.88 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.069 -0.514 . . . . 74.1 110.919 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.352 0 CA-C-O 121.603 0.716 . . . . 61.13 110.932 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.694 0.206 . . . . 71.32 112.293 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.473 ' CH2' HG21 ' A' ' 153' ' ' VAL . 47.0 p-90 -54.82 -26.63 36.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 75.24 110.925 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -84.31 102.33 12.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 54.14 110.876 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 -76.39 -40.05 51.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 72.5 110.897 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.3 18.89 37.6 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.744 -0.741 . . . . 64.12 112.472 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -179.96 78.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.737 0.303 . . . . 74.31 110.864 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.5 mm -142.72 144.41 24.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 63.43 111.061 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.46 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -101.32 175.08 5.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.113 -0.494 . . . . 73.5 111.177 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.46 ' H ' HG22 ' A' ' 88' ' ' THR . 6.6 ttt180 -62.19 -42.71 99.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 75.15 110.883 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -68.34 -33.87 75.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.162 -0.472 . . . . 72.24 110.939 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -75.49 -41.78 54.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 74.32 110.922 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.48 -33.48 62.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.482 . . . . 55.12 111.129 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.448 ' OE2' HG21 ' A' ' 126' ' ' VAL . 20.3 mm-40 -63.4 -53.27 54.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.45 . . . . 75.33 110.922 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.18 -35.6 81.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.479 . . . . 74.13 110.832 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 16.7 mt -61.21 -35.82 78.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 55.41 110.892 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.669 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.5 mm? -102.96 43.12 1.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.19 -0.459 . . . . 63.33 110.878 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.495 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.18 -59.97 4.63 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.678 0.751 . . . . 72.04 110.907 179.996 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.9 Cg_endo -69.74 123.09 9.77 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.719 2.279 . . . . 65.4 112.323 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 118.21 5.54 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.665 2.243 . . . . 63.23 112.334 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -154.81 100.48 2.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.27 -0.423 . . . . 71.23 110.858 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.665 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.6 OUTLIER -53.46 111.76 0.77 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 74.25 111.146 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.81 -6.28 6.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.79 -0.719 . . . . 63.34 112.504 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.28 111.75 23.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.808 0.337 . . . . 73.12 110.916 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -124.54 162.06 24.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 73.31 110.89 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.578 HD23 HD21 ' A' ' 96' ' ' LEU . 0.7 OUTLIER -158.37 138.67 12.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 44.34 110.873 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.838 HG22 HD22 ' A' ' 118' ' ' LEU . 79.9 t -110.16 137.73 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 64.22 111.145 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -149.8 143.39 25.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.212 -0.449 . . . . 75.54 110.882 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -50.24 123.78 9.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.447 . . . . 75.53 110.823 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 m -57.56 115.79 2.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.456 . . . . 72.23 110.86 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.617 HG21 ' HB2' ' B' ' 298' ' ' SER . 2.2 m -68.57 -56.39 8.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 61.34 111.133 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.619 ' CG ' HD12 ' B' ' 310' ' ' ILE . 4.3 m-80 -69.28 -26.62 64.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 71.43 110.921 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.407 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 2.7 m-85 -112.28 94.46 26.62 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.632 0.729 . . . . 70.14 110.939 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.5 Cg_endo -69.77 112.26 3.03 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.663 2.242 . . . . 55.45 112.384 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.77 3.29 23.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.743 -0.741 . . . . 74.22 112.434 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -131.05 -176.06 3.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.816 0.341 . . . . 65.01 110.907 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -131.67 165.58 23.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 74.31 110.929 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 99.1 m -126.56 141.61 51.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.086 -0.506 . . . . 72.31 111.184 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.838 HD22 HG22 ' A' ' 106' ' ' VAL . 0.0 OUTLIER -109.16 106.32 16.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.279 -0.418 . . . . 75.33 110.885 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.6 m -98.99 118.69 36.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.47 . . . . 60.45 110.911 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.4 t -124.36 150.41 29.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 72.23 111.045 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.669 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -103.95 112.36 25.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 71.45 110.941 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.6 97.58 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.07 -0.514 . . . . 72.33 110.849 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 65.74 27.61 11.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.884 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.75 -13.38 63.92 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.752 -0.737 . . . . 72.23 112.498 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -88.38 140.3 29.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.764 0.316 . . . . 70.45 110.936 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.59 ' O ' HD13 ' B' ' 294' ' ' LEU . 11.2 m -100.47 111.37 29.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 70.2 111.13 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.454 ' OE2' HD11 ' B' ' 294' ' ' LEU . 2.7 mm-40 -99.68 124.84 45.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.89 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 61.1 m-70 -103.39 124.0 47.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 61.45 110.873 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.523 ' HB3' HD13 ' A' ' 140' ' ' ILE . 88.5 m-85 -114.67 100.24 8.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 72.32 110.964 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -55.54 131.76 46.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 74.34 110.834 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.819 HD11 HD23 ' A' ' 118' ' ' LEU . 38.2 mt -110.45 109.63 29.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 72.23 111.133 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.76 129.08 34.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.11 110.924 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.46 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.97 100.71 8.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.271 -0.422 . . . . 63.12 110.974 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -134.68 142.43 46.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 74.43 110.913 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 57.38 36.13 26.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 63.41 111.058 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.7 t 61.04 27.46 17.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 64.3 110.858 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 2.7 mtmm -133.21 145.34 50.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.136 -0.484 . . . . 75.41 110.82 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.46 HD21 ' CE2' ' A' ' 133' ' ' TYR . 1.6 mp -106.22 150.8 25.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 71.02 110.909 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.9 t -169.62 140.8 2.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 74.12 110.862 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.526 HD11 HG12 ' A' ' 131' ' ' ILE . 59.7 mt -115.51 -26.19 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 61.13 111.175 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.689 ' HB3' HG21 ' B' ' 317' ' ' VAL . 5.9 p30 -96.67 -2.48 44.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 53.52 110.884 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 61.94 16.75 8.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 63.02 110.882 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -127.36 -34.07 2.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 72.33 110.894 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.4 t -111.86 104.75 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 64.01 111.127 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -98.33 143.44 28.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.47 . . . . 75.33 110.931 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . 0.44 ' CD1' HD12 ' A' ' 152' ' ' LEU . 48.4 m-85 -117.51 171.53 7.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.083 -0.508 . . . . 74.11 110.862 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.68 -18.95 24.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.193 -0.458 . . . . 75.53 110.861 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.508 ' OD1' HD12 ' A' ' 149' ' ' LEU . 45.6 t30 -171.24 158.84 5.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 75.2 110.905 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.508 HD12 ' OD1' ' A' ' 148' ' ' ASN . 2.4 mp -51.36 -36.88 45.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 72.14 110.961 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.4 ttp -51.87 -48.87 63.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 74.5 110.939 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -68.99 -41.67 77.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 71.45 110.943 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.44 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.5 OUTLIER -56.0 -50.55 70.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 51.4 110.906 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.473 HG21 ' CH2' ' A' ' 82' ' ' TRP . 91.4 t -59.02 -43.67 89.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 72.31 111.141 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.78 -39.51 71.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 72.32 110.896 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.75 -50.74 48.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 71.34 110.842 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.424 ' CD1' HD13 ' A' ' 163' ' ' LEU . 38.2 m-85 -65.46 -19.63 66.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.469 . . . . 74.2 110.934 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.475 ' OG1' HD12 ' A' ' 167' ' ' LEU . 97.3 m -84.24 -28.77 27.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.13 -0.486 . . . . 74.31 111.041 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 27.2 m -81.92 -24.4 35.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.331 -0.395 . . . . 71.33 111.148 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -161.7 162.25 29.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 64.15 110.874 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.46 -58.1 7.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.207 -0.451 . . . . 64.15 111.0 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.76 20.5 10.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 75.42 110.911 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 112.3 13.53 11.83 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 14.5 112.483 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.424 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.6 mp -108.75 138.41 45.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.85 0.357 . . . . 75.23 110.936 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 31.6 t -51.66 -31.17 24.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.901 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 7.2 t -153.99 124.17 6.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.141 -0.481 . . . . 62.01 111.15 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -51.88 156.08 1.59 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 65.2 110.845 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.475 HD12 ' OG1' ' A' ' 157' ' ' THR . 7.7 mt -72.51 134.93 45.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 72.03 110.947 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.665 HD12 ' O ' ' A' ' 101' ' ' THR . 24.6 mt -127.03 -51.11 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.191 -0.459 . . . . 73.12 111.179 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -127.55 121.13 22.18 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.534 0.683 . . . . 74.1 110.866 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 135.13 29.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.694 2.263 . . . . 65.4 112.349 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.66 84.04 0.44 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 73.11 110.914 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 22.0 t -64.42 131.42 30.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 72.31 111.099 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 33.3 mtp . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 75.43 110.881 179.91 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.59 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.812 0.339 . . . . 74.22 110.888 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 2.2 m -113.59 89.03 2.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 64.21 110.866 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -72.32 148.26 45.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.51 . . . . 75.23 110.896 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -143.12 129.08 19.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.089 -0.505 . . . . 74.53 110.879 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . 0.617 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -92.04 158.77 16.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.232 -0.44 . . . . 72.14 110.781 -179.862 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -59.76 -19.01 47.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 73.43 110.817 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -37.2 86.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 71.4 110.887 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -96.59 -17.6 20.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 74.44 110.872 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -155.05 79.92 4.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.583 0.706 . . . . 71.22 110.843 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -5.69 16.79 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.654 2.236 . . . . 62.1 112.353 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.4 t -92.68 27.53 2.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 73.42 111.132 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 23.8 mt -102.01 136.79 41.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.424 . . . . 72.33 110.922 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.642 HG22 ' HG2' ' B' ' 309' ' ' GLU . 12.1 t -105.98 174.84 5.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 74.4 111.151 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -49.6 -37.97 29.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 72.42 110.868 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.61 -51.83 66.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.149 -0.478 . . . . 74.23 110.846 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.642 ' HG2' HG22 ' B' ' 306' ' ' THR . 20.5 mm-40 -63.43 -52.08 63.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 74.05 110.909 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.619 HD12 ' CG ' ' A' ' 111' ' ' ASN . 43.1 mm -56.83 -53.78 37.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 72.12 111.1 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 26.3 t -58.85 -22.44 58.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.441 . . . . 63.24 110.868 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.53 4.13 25.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 74.34 111.065 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.863 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 CA--C 1.526 0.058 0 CA-C-O 120.959 0.409 . . . . 72.45 110.903 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 64.74 153.66 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.049 -0.523 . . . . 70.23 110.822 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.689 HG21 ' HB3' ' A' ' 141' ' ' ASP . 4.6 m -52.56 126.34 8.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.097 -0.501 . . . . 54.13 111.135 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -136.61 77.47 1.65 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 75.42 110.939 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? . . . . . 0 C--N 1.33 -0.277 0 CA-C-O 121.511 0.672 . . . . 73.12 110.95 179.914 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 N--CA 1.466 -0.113 0 CA-C-O 120.829 0.262 . . . . 62.32 112.402 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.469 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 35.1 p-90 -101.25 -29.41 12.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 74.33 110.897 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -90.3 106.58 18.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.278 -0.419 . . . . 72.51 110.939 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -83.63 -41.81 17.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 75.44 110.839 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 52.14 34.48 39.77 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.703 -0.761 . . . . 55.11 112.477 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.17 34.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.776 0.322 . . . . 64.2 110.864 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.7 mm -102.69 144.2 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 55.22 111.153 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.06 157.43 17.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 75.1 111.108 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.3 ppt_? -52.94 -36.95 60.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 74.41 110.896 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.2 -32.08 55.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 75.22 110.886 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -72.88 -35.23 67.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 74.13 110.929 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.99 -34.78 59.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 70.24 111.092 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -63.3 -52.69 60.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 72.24 110.863 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -39.51 94.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 71.43 110.811 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.3 mt -54.99 -39.34 68.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.276 -0.42 . . . . 73.41 110.943 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.639 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -99.01 43.38 1.06 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.904 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.494 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.42 -59.92 5.43 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.711 0.767 . . . . 71.22 110.926 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.69 123.41 10.1 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.719 2.279 . . . . 75.11 112.418 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 117.53 5.13 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.659 2.239 . . . . 64.25 112.379 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -154.75 112.34 3.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.455 . . . . 70.43 110.965 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.667 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.7 OUTLIER -63.92 111.73 2.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.466 . . . . 70.12 111.209 -179.9 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.95 -6.2 6.1 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.713 -0.756 . . . . 42.44 112.463 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.405 HD12 ' O ' ' A' ' 169' ' ' LYS . 2.4 tp -90.94 113.99 26.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.824 0.345 . . . . 72.1 110.922 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.444 ' HB3' HD22 ' A' ' 167' ' ' LEU . 18.9 p90 -125.55 166.09 17.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.141 -0.481 . . . . 62.34 110.863 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.556 HD23 HD21 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -163.93 138.33 5.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.151 -0.477 . . . . 64.42 110.907 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.469 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 90.5 t -110.37 128.22 66.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 42.12 111.141 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 145.13 42.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 71.23 110.821 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.62 127.15 19.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 63.13 110.864 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.8 m -61.82 113.34 2.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 52.33 110.87 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.543 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.8 m -69.31 -55.99 8.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.487 . . . . 52.42 111.083 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.63 ' CG ' HD12 ' B' ' 310' ' ' ILE . 42.4 m-80 -63.57 -28.97 70.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 73.22 110.888 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.427 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 33.8 m-85 -119.76 96.94 49.76 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.757 0.789 . . . . 64.42 110.94 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.7 Cg_endo -69.77 119.15 6.15 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.672 2.248 . . . . 62.52 112.375 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.73 -12.82 22.76 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.727 . . . . 71.32 112.499 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -114.26 -178.55 3.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.807 0.337 . . . . 75.03 110.85 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -131.05 160.21 35.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 62.32 110.964 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 58.8 m -133.36 131.85 40.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 73.55 111.12 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.445 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.3 OUTLIER -100.98 121.39 41.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 63.54 110.836 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.3 m -105.36 126.18 51.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.109 -0.496 . . . . 72.0 110.918 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.445 ' CG2' HD21 ' A' ' 118' ' ' LEU . 16.1 t -126.0 151.89 32.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.174 -0.466 . . . . 74.43 111.079 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.639 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.47 111.72 24.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 73.34 110.874 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.7 93.27 4.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.143 -0.481 . . . . 63.25 110.839 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 66.19 29.72 9.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 71.32 110.962 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.99 -13.42 63.54 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.715 -0.755 . . . . 40.2 112.525 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.2 ptpt -88.3 139.25 30.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.33 . . . . 72.42 110.884 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.602 ' O ' HD13 ' B' ' 294' ' ' LEU . 94.0 t -99.66 104.69 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 71.04 111.169 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -92.81 122.06 34.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 54.51 110.918 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -100.84 124.85 47.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.13 -0.486 . . . . 72.41 110.85 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -111.9 118.69 36.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.22 -0.445 . . . . 63.51 110.937 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -68.16 134.99 51.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 72.2 110.87 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.47 ' CG2' HD23 ' A' ' 138' ' ' LEU . 53.2 mt -117.59 109.59 28.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.476 . . . . 74.02 111.15 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.8 129.18 34.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 73.12 110.894 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.461 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.64 98.99 7.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 72.21 110.89 -179.822 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -130.94 142.44 50.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 73.34 110.908 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.12 36.77 27.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 72.24 111.07 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.26 23.95 14.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 73.11 110.817 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 3.8 mtmt -128.93 140.48 51.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.164 -0.471 . . . . 72.53 110.947 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.47 HD23 ' CG2' ' A' ' 131' ' ' ILE . 2.8 mp -101.73 151.93 21.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 72.32 110.945 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 39.6 t -168.43 142.22 3.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.874 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.443 HG22 HG13 ' B' ' 317' ' ' VAL . 52.6 mt -115.54 -40.83 3.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 72.32 111.125 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.703 ' HB3' HG21 ' B' ' 317' ' ' VAL . 38.1 p-10 -88.0 -1.04 57.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 61.02 110.93 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 59.6 20.04 8.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 65.43 110.877 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -123.23 -35.61 2.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 65.12 110.779 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.454 HG12 ' OD2' ' A' ' 141' ' ' ASP . 2.6 p -119.11 105.02 16.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 71.44 111.056 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -92.92 153.93 18.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 75.45 110.896 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -124.3 174.23 7.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 73.14 110.936 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.76 -17.91 21.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.01 110.849 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -171.82 158.85 5.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.478 . . . . 63.02 110.899 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.86 -36.02 46.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 64.43 110.9 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 2.6 ttt -53.03 -49.55 66.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 73.34 110.946 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -67.84 -39.69 83.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 71.23 110.948 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.9 -51.63 66.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 70.23 110.928 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.569 HG13 HD12 ' A' ' 167' ' ' LEU . 98.8 t -59.72 -42.85 90.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.23 111.078 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -54.39 -37.77 65.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 63.31 110.831 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -50.42 28.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 63.24 110.813 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.559 ' CD1' HD13 ' A' ' 163' ' ' LEU . 48.6 m-85 -66.49 -14.6 62.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 75.32 110.895 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 81.7 m -88.73 -32.35 17.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 70.23 111.119 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.9 m -80.27 -22.55 41.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 62.13 111.19 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -161.89 161.96 29.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 73.43 110.892 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.94 -58.07 6.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 73.12 111.124 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.87 18.45 10.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.468 . . . . 74.21 110.836 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.57 3.59 27.05 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.701 -0.761 . . . . 44.55 112.484 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.559 HD13 ' CD1' ' A' ' 156' ' ' TYR . 7.2 mp -95.61 138.63 33.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.85 0.357 . . . . 71.2 110.986 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 41.0 t -51.52 -29.87 18.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 73.53 110.948 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.7 t -156.17 122.76 5.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 74.4 111.101 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -51.28 147.36 5.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 63.24 110.898 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.569 HD12 HG13 ' A' ' 153' ' ' VAL . 6.8 mt -65.78 133.86 51.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 73.52 110.987 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.667 HD12 ' O ' ' A' ' 101' ' ' THR . 28.1 mt -127.12 -51.32 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.153 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . 0.405 ' O ' HD12 ' A' ' 103' ' ' LEU . 6.0 mtpm? -126.67 118.38 22.71 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.481 0.657 . . . . 75.23 110.961 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.68 139.95 41.79 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.689 2.26 . . . . 51.5 112.36 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . 0.404 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -70.07 82.94 0.51 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 73.31 110.912 179.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 15.8 m -64.81 125.99 22.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.278 -0.419 . . . . 71.32 111.171 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 30.3 mtp . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 72.54 110.847 179.969 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.602 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.3 OUTLIER . . . . . 0 CA--C 1.526 0.041 0 CA-C-O 120.857 0.36 . . . . 75.3 110.868 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 12.2 t -119.99 88.33 2.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 75.35 110.912 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -75.09 149.25 39.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 64.05 110.881 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.98 129.14 19.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.097 -0.501 . . . . 65.31 110.911 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . 0.543 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -91.42 163.62 14.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 63.12 110.851 -179.844 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -64.06 -14.98 58.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.074 -0.512 . . . . 74.0 110.86 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -37.34 79.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 53.12 110.86 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -98.11 -18.21 18.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.103 -0.499 . . . . 74.1 110.893 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.432 ' HB2' HD11 ' B' ' 305' ' ' LEU . 8.0 m-20 -151.47 78.06 7.1 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.65 0.738 . . . . 75.24 110.923 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -5.95 17.39 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.681 2.254 . . . . 73.32 112.382 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.6 t -93.32 27.5 2.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.113 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' B' ' 302' ' ' ASP . 31.3 mt -101.45 136.82 40.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 54.1 110.894 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.645 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -106.03 173.55 6.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 55.13 111.09 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -49.4 -37.77 26.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 71.11 110.873 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -60.91 -53.02 62.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 53.23 110.912 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.645 ' HG2' HG22 ' B' ' 306' ' ' THR . 15.0 mm-40 -62.93 -52.44 63.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.195 -0.457 . . . . 74.54 110.91 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.63 HD12 ' CG ' ' A' ' 111' ' ' ASN . 41.9 mm -55.9 -53.92 32.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.11 -0.496 . . . . 75.4 111.154 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 60.5 p -58.71 -21.8 55.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 75.42 110.86 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.23 4.09 24.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 55.21 111.101 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . 0.573 ' HE2' HD13 ' B' ' 310' ' ' ILE . 1.9 mtm . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.458 . . . . 53.44 110.935 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 11.6 t . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.803 0.335 . . . . 64.32 110.779 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.77 132.67 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.465 . . . . 60.41 110.806 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.703 HG21 ' HB3' ' A' ' 141' ' ' ASP . 20.7 m -52.47 125.64 6.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.042 -0.527 . . . . 71.43 111.13 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -130.59 76.34 1.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 75.31 110.841 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 30.4 mttt . . . . . 0 C--N 1.329 -0.297 0 CA-C-O 121.601 0.715 . . . . 74.3 110.859 179.87 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 N--CA 1.465 -0.179 0 CA-C-O 120.767 0.236 . . . . 73.05 112.347 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.476 ' CH2' HG21 ' A' ' 153' ' ' VAL . 42.9 p-90 -99.98 -29.81 12.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.221 -0.445 . . . . 74.42 110.832 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -85.78 99.3 11.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.261 -0.427 . . . . 65.23 110.895 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.88 -37.0 59.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 62.42 110.796 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.61 19.61 35.52 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.722 -0.752 . . . . 43.52 112.509 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.65 80.51 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.7 0.286 . . . . 53.55 110.82 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.589 HG23 ' HB3' ' A' ' 91' ' ' GLN . 27.2 mm -145.12 144.99 21.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.277 -0.419 . . . . 61.41 111.175 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.3 p -100.38 177.09 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.214 -0.448 . . . . 64.3 111.216 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 64.1 ttt-85 -63.75 -41.22 98.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 62.15 110.858 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.36 -36.79 83.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.435 . . . . 74.45 110.914 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.589 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -75.25 -39.8 59.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 71.32 110.969 -179.938 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.46 -33.94 65.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 71.41 111.074 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -65.0 -53.34 47.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.445 . . . . 72.24 110.887 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -35.55 81.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.46 . . . . 74.23 110.891 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.55 -35.43 77.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 52.03 110.926 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.638 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -105.48 43.38 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.11 110.951 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.488 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.98 -60.21 4.56 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.748 0.785 . . . . 62.54 110.933 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.3 Cg_endo -69.79 123.64 10.29 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.663 2.242 . . . . 73.23 112.343 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.8 117.57 5.16 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.717 2.278 . . . . 71.24 112.392 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -154.72 110.3 3.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.889 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.664 ' O ' HD12 ' A' ' 168' ' ' ILE . 1.1 p -61.98 111.88 2.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 75.02 111.114 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.68 -6.88 6.2 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 73.13 112.491 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.439 HD21 ' HE3' ' A' ' 171' ' ' LYS . 2.7 tp -90.72 111.79 23.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.855 0.36 . . . . 74.1 110.859 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.418 ' HB3' HD22 ' A' ' 167' ' ' LEU . 18.9 p90 -123.12 167.63 13.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 73.42 110.879 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.576 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -163.39 137.13 5.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.114 -0.494 . . . . 73.21 110.883 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.44 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 90.1 t -110.4 135.16 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 74.35 111.143 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -149.1 140.51 23.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 53.35 110.888 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -50.96 124.01 10.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.437 . . . . 61.2 110.857 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.7 t -55.44 119.38 5.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 50.13 110.866 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 94.1 m -70.15 -56.15 7.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 71.12 111.111 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -63.42 -42.64 98.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.255 -0.43 . . . . 70.14 110.871 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -106.01 96.08 12.24 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.621 0.724 . . . . 74.42 110.923 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 122.21 8.88 Favored 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 122.647 2.232 . . . . 74.23 112.342 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.75 -9.64 23.57 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.757 -0.735 . . . . 74.23 112.479 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -118.64 176.89 5.05 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.768 0.318 . . . . 62.25 110.925 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -124.13 158.68 31.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.285 -0.416 . . . . 72.31 110.93 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.5 m -132.19 121.67 24.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 72.31 111.194 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.443 HD23 ' CD1' ' A' ' 129' ' ' TYR . 0.4 OUTLIER -95.01 116.84 29.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 73.24 110.916 179.974 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 1.8 t -102.33 125.53 49.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.278 -0.419 . . . . 53.04 110.811 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.1 t -125.68 151.39 31.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 63.12 111.141 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.638 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.06 112.07 24.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.476 . . . . 75.53 110.843 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.55 94.36 4.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 75.23 110.904 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 66.56 29.15 9.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.33 110.925 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 98.0 -14.3 62.79 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.7 -0.762 . . . . 72.12 112.523 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.88 139.65 30.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.806 0.336 . . . . 64.41 110.973 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.447 ' O ' HG23 ' A' ' 126' ' ' VAL . 6.2 m -98.84 99.68 9.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.289 -0.414 . . . . 73.53 111.157 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -86.67 123.75 32.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 73.24 110.915 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 53.6 m-70 -101.38 127.15 48.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.118 -0.492 . . . . 74.3 110.946 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.443 ' CD1' HD23 ' A' ' 118' ' ' LEU . 69.5 m-85 -113.48 106.23 14.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 71.43 110.933 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -58.26 137.25 57.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 72.13 110.902 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.448 ' CG2' HD23 ' A' ' 138' ' ' LEU . 61.8 mt -117.97 107.31 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 74.15 111.163 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.77 126.68 31.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 73.33 110.874 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -113.88 114.62 26.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.456 . . . . 74.43 110.936 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -149.72 138.37 20.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.137 -0.483 . . . . 72.24 110.922 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 53.66 35.83 22.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 64.41 111.094 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.72 28.81 16.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 63.53 110.863 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -129.36 140.1 51.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 71.41 110.847 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.448 HD23 ' CG2' ' A' ' 131' ' ' ILE . 1.8 mp -105.51 147.22 28.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 61.4 110.883 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 28.0 t -164.45 139.17 5.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 73.02 110.874 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.43 HG22 HG13 ' B' ' 317' ' ' VAL . 46.2 mt -115.53 -40.85 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.145 -0.48 . . . . 60.11 111.152 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.483 ' HA ' HG21 ' B' ' 317' ' ' VAL . 20.7 p30 -83.86 -7.02 59.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 71.14 110.882 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 61.79 16.12 7.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.187 -0.46 . . . . 73.4 110.889 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -123.23 -11.29 7.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 71.03 110.916 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -143.07 104.36 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.156 -0.474 . . . . 63.34 111.118 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -92.58 144.68 25.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.23 110.885 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -115.17 175.37 5.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.096 -0.502 . . . . 74.54 110.868 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.34 -13.92 18.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 45.21 110.932 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -168.7 171.84 8.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 65.11 110.883 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 mp -73.87 -24.02 59.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 70.32 110.908 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -59.6 -56.89 16.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 74.51 110.889 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -68.08 -36.5 79.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 61.32 110.885 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.47 -52.98 61.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.245 -0.434 . . . . 72.34 110.968 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.476 HG21 ' CH2' ' A' ' 82' ' ' TRP . 56.9 t -62.61 -36.22 74.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.116 -0.493 . . . . 73.33 111.133 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -55.33 -39.49 70.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 74.45 110.883 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -71.89 -50.3 30.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 74.25 110.838 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -62.71 -22.32 66.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 74.04 110.95 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.654 ' OG1' HD12 ' A' ' 167' ' ' LEU . 89.1 m -86.38 -27.13 24.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 72.13 111.166 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 90.0 m -79.4 -23.66 43.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 74.4 111.095 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.76 165.45 23.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.249 -0.432 . . . . 64.24 110.892 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.27 -58.3 6.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.46 . . . . 40.42 111.101 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 58.65 21.38 8.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.119 -0.491 . . . . 70.34 110.814 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 106.75 16.69 13.39 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.692 -0.766 . . . . 73.43 112.465 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.6 mp -107.3 140.31 40.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.833 0.349 . . . . 64.32 110.933 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 48.6 t -51.78 -29.89 20.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 73.2 110.912 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.7 t -159.4 123.58 3.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 75.54 111.176 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.96 146.16 6.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 62.22 110.884 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.654 HD12 ' OG1' ' A' ' 157' ' ' THR . 7.3 mt -65.0 136.68 57.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 75.22 110.903 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.664 HD12 ' O ' ' A' ' 101' ' ' THR . 28.1 mt -127.06 -51.23 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.273 -0.421 . . . . 72.24 111.167 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.21 119.63 19.73 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.659 0.742 . . . . 72.34 110.851 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 140.76 43.39 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.73 2.287 . . . . 71.23 112.361 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . 0.439 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -70.67 82.72 0.61 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 72.53 110.891 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 26.8 m -64.89 129.03 28.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.411 . . . . 64.2 111.079 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.9 ptm . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 64.51 110.853 179.912 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.893 0.378 . . . . 72.21 110.911 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 9.4 t -123.03 88.07 2.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 74.21 110.795 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -76.19 149.06 37.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.107 -0.497 . . . . 73.55 110.937 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -158.2 129.73 6.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 70.42 110.884 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.13 175.83 5.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.245 -0.434 . . . . 44.32 110.873 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 26.5 mtt180 -64.48 -15.67 61.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 73.01 110.864 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -41.83 99.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 71.13 110.906 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -104.2 -10.38 17.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.099 -0.5 . . . . 52.15 110.937 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.529 ' HB2' HD11 ' B' ' 305' ' ' LEU . 7.1 m-20 -158.15 78.6 3.33 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.598 0.713 . . . . 75.51 110.872 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -6.12 17.81 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.697 2.264 . . . . 61.12 112.344 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.9 t -93.18 27.18 2.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.246 -0.434 . . . . 73.25 111.102 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.529 HD11 ' HB2' ' B' ' 302' ' ' ASP . 31.2 mt -105.1 137.97 42.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.436 . . . . 72.13 110.894 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.605 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -103.66 173.46 6.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 40.32 111.209 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -50.33 -32.83 18.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 73.42 110.918 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . 0.462 ' H ' HG23 ' B' ' 306' ' ' THR . 0.1 OUTLIER -65.83 -47.64 74.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 64.12 110.855 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.605 ' HG2' HG22 ' B' ' 306' ' ' THR . 20.5 mm-40 -67.42 -52.35 40.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 75.13 110.904 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 46.0 mm -55.94 -46.79 80.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 70.23 111.152 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 27.9 p -72.06 -17.03 62.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.855 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.39 2.42 32.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 61.43 111.17 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 61.43 110.902 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.859 0.362 . . . . 74.12 110.849 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 65.15 151.05 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 72.42 110.874 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.483 HG21 ' HA ' ' A' ' 141' ' ' ASP . 6.7 m -51.47 122.58 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 73.31 111.132 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -135.26 76.7 1.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 75.22 110.927 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? . . . . . 0 C--N 1.329 -0.317 0 CA-C-O 121.618 0.723 . . . . 73.21 110.877 179.934 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo . . . . . 0 C--O 1.231 0.172 0 CA-C-O 120.796 0.248 . . . . 54.01 112.378 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.564 ' CH2' HD12 ' A' ' 149' ' ' LEU . 46.2 p-90 -101.94 -29.37 11.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.03 110.898 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -85.59 99.56 11.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 75.13 110.818 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -75.88 -38.77 57.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 62.4 110.831 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.34 20.66 45.25 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.736 -0.745 . . . . 41.33 112.502 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 179.38 66.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 64.3 110.932 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.555 HG21 ' HB2' ' A' ' 92' ' ' ALA . 7.3 mm -129.58 144.74 37.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.443 . . . . 75.41 111.106 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.447 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -95.33 176.98 5.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.19 -0.459 . . . . 73.21 111.144 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.447 ' H ' HG22 ' A' ' 88' ' ' THR . 0.0 OUTLIER -66.67 -38.25 86.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.24 110.858 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.87 -33.63 62.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.445 . . . . 61.21 110.847 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -73.54 -41.33 63.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.24 110.832 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.555 ' HB2' HG21 ' A' ' 87' ' ' ILE . . . -75.32 -33.65 61.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 74.52 111.097 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -62.16 -53.47 54.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 73.23 110.863 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -38.49 91.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.12 110.892 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 92' ' ' ALA . 15.5 mt -54.99 -38.91 68.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.181 -0.463 . . . . 75.51 110.905 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.594 HD12 ' CB ' ' A' ' 121' ' ' SER . 1.6 mm? -101.26 43.7 1.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 72.31 110.892 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.5 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -66.89 -59.46 7.72 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.656 0.741 . . . . 72.44 110.978 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.81 123.11 9.76 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.697 2.264 . . . . 74.5 112.312 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 119.1 6.1 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.683 2.255 . . . . 61.44 112.34 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -155.09 108.99 2.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 74.31 110.95 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.663 ' O ' HD12 ' A' ' 168' ' ' ILE . 1.0 OUTLIER -60.92 117.17 5.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 62.4 111.153 -179.902 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 123.83 -6.49 8.96 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.734 -0.746 . . . . 53.31 112.493 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 tp -91.2 116.02 28.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 64.24 110.869 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.601 ' HB3' HD22 ' A' ' 167' ' ' LEU . 14.9 p90 -128.25 163.38 24.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 72.21 110.866 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.556 HD23 HD21 ' A' ' 96' ' ' LEU . 1.1 pp -161.18 134.83 6.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.494 . . . . 74.23 110.886 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 87.0 t -109.65 136.03 46.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 73.12 111.133 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -147.13 144.24 28.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 64.52 110.874 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -51.66 124.19 11.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.471 . . . . 73.15 110.88 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 m -57.22 116.05 3.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 63.03 110.806 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 78.8 m -69.31 -56.39 7.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.103 -0.499 . . . . 71.13 111.115 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.433 ' OD1' HG21 ' B' ' 310' ' ' ILE . 21.3 p30 -71.7 -26.57 62.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.238 -0.437 . . . . 72.23 110.866 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.71 90.24 7.23 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.768 0.794 . . . . 72.01 110.886 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 112.32 3.05 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.671 2.247 . . . . 61.3 112.336 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.58 6.0 21.95 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.718 -0.753 . . . . 54.41 112.502 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -136.16 178.76 6.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.829 0.347 . . . . 71.25 110.871 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 99.2 m-85 -128.58 160.48 32.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.446 . . . . 75.13 110.948 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 93.4 m -131.68 140.27 49.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 52.44 111.137 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.403 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.3 OUTLIER -112.13 120.59 42.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 72.53 110.859 179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 3.8 t -103.36 126.19 50.39 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.144 -0.48 . . . . 75.05 110.923 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.403 ' CG2' HD21 ' A' ' 118' ' ' LEU . 19.3 t -128.06 146.3 33.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 72.54 111.107 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.594 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -99.41 110.43 22.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 34.42 110.896 -179.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.49 94.05 4.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.135 -0.484 . . . . 72.22 110.913 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 66.92 28.81 8.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 74.22 110.828 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.75 -16.22 60.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.732 -0.747 . . . . 44.13 112.503 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -87.99 139.78 30.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.839 0.352 . . . . 71.23 110.888 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.437 ' O ' HG23 ' A' ' 126' ' ' VAL . 11.4 m -98.06 110.3 25.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 74.02 111.117 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -97.03 113.62 25.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 72.52 110.828 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -90.77 124.76 35.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 64.22 110.848 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.615 ' CE1' HD13 ' A' ' 163' ' ' LEU . 58.3 m-85 -115.54 108.93 17.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 71.22 110.935 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.02 142.54 58.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.14 -0.482 . . . . 73.55 110.834 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.454 HG22 HD23 ' A' ' 138' ' ' LEU . 30.8 mt -122.59 111.66 31.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.215 -0.448 . . . . 64.51 111.152 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -84.1 130.11 34.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 72.23 110.833 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.459 ' CE2' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.32 100.75 8.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 73.25 110.92 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -134.4 142.57 47.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 74.15 110.852 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.9 37.69 28.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.129 -0.487 . . . . 62.01 111.08 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.73 31.59 21.33 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.983 0.421 . . . . 71.13 110.89 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 4.0 mtmm -138.41 143.34 39.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.099 -0.5 . . . . 74.51 110.83 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.608 HD22 HD22 ' A' ' 149' ' ' LEU . 1.4 mp -104.25 151.67 23.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.25 110.953 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -169.4 144.99 3.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.238 -0.437 . . . . 72.14 110.839 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.413 HG22 HG13 ' B' ' 317' ' ' VAL . 47.8 mt -115.61 -37.83 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.103 -0.499 . . . . 74.13 111.122 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.499 ' HB3' HG11 ' B' ' 317' ' ' VAL . 9.8 p30 -88.77 -0.3 57.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 72.43 110.896 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 60.93 17.35 7.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.23 -0.441 . . . . 73.42 110.905 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -125.27 -32.48 2.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 71.4 110.864 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -113.65 104.62 17.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 71.51 111.081 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -97.74 143.86 27.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 74.34 110.97 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -119.06 175.18 5.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.05 -0.523 . . . . 71.31 110.886 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.05 -16.38 20.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 74.14 110.912 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -172.49 159.71 4.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 65.53 110.895 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.608 HD22 HD22 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -52.21 -39.19 59.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 71.3 110.978 179.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.8 ttt -51.03 -49.74 59.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 71.34 110.872 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -66.93 -39.85 87.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 64.2 110.941 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.07 -50.69 71.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 44.34 110.912 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.479 HG21 ' CH2' ' A' ' 82' ' ' TRP . 96.8 t -57.95 -44.24 86.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 74.11 111.108 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -53.27 -40.17 64.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 73.11 110.954 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -52.96 17.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.17 -0.468 . . . . 70.43 110.894 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.41 ' CE1' HD23 ' A' ' 163' ' ' LEU . 36.2 m-85 -62.27 -17.48 58.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 71.3 110.893 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.443 HG23 ' O ' ' A' ' 167' ' ' LEU . 80.9 m -85.91 -32.81 21.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 64.33 111.152 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 3.2 m -82.12 -16.3 50.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 75.04 111.154 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -177.38 131.85 0.17 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 74.41 110.872 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . 0.41 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -50.3 -58.45 5.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 65.34 111.077 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 50.86 37.93 18.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 70.03 110.855 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 129.76 0.45 5.67 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.728 -0.748 . . . . 43.41 112.461 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.615 HD13 ' CE1' ' A' ' 129' ' ' TYR . 2.5 mm? -106.73 139.58 40.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.835 0.35 . . . . 45.14 110.975 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 53.7 t -56.79 -21.72 30.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 74.15 110.893 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.8 t -162.2 116.36 1.84 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.143 -0.48 . . . . 71.05 111.119 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.41 138.02 13.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 60.14 110.864 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.601 HD22 ' HB3' ' A' ' 104' ' ' PHE . 8.4 mt -61.34 126.71 28.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.441 . . . . 75.44 110.848 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.663 HD12 ' O ' ' A' ' 101' ' ' THR . 51.3 mt -109.71 -51.49 6.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 75.4 111.112 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . 0.412 ' HE3' HG22 ' A' ' 168' ' ' ILE . 3.8 mtmp? -136.77 139.71 29.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.562 0.696 . . . . 75.14 110.858 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.82 139.46 40.08 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.631 2.221 . . . . 61.22 112.276 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.54 84.3 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 74.12 110.885 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 29.2 m -63.95 131.01 29.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 64.14 111.106 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.5 ptt? . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 64.3 110.923 179.841 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.821 0.343 . . . . 63.55 110.889 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 10.3 t -101.71 87.87 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 65.34 110.902 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -83.53 119.53 24.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 74.22 110.863 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -120.72 128.52 53.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 75.22 110.939 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.22 172.63 8.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 64.13 110.913 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 51.3 mtt180 -62.52 -16.41 55.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 74.41 110.838 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -37.78 84.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 64.01 110.893 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -104.01 -23.9 13.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 73.52 110.854 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.435 ' HB2' HD11 ' B' ' 305' ' ' LEU . 3.6 m-20 -143.28 78.89 14.57 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.619 0.723 . . . . 73.32 110.857 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -6.16 17.94 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.663 2.242 . . . . 70.21 112.35 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.7 t -93.64 27.58 2.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 64.3 111.119 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.435 HD11 ' HB2' ' B' ' 302' ' ' ASP . 36.8 mt -100.7 147.73 25.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 55.44 110.979 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.611 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.3 t -113.31 173.77 6.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 74.44 111.122 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -48.81 -36.91 17.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.204 -0.453 . . . . 65.54 110.9 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -62.45 -49.89 73.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 72.45 110.9 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.611 ' HG2' HG22 ' B' ' 306' ' ' THR . 18.5 mm-40 -64.12 -48.72 75.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 72.44 110.834 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.433 HG21 ' OD1' ' A' ' 111' ' ' ASN . 42.5 mm -61.94 -35.65 69.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 71.22 111.111 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 10.8 t -77.51 -15.71 59.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 64.34 110.813 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.41 3.62 27.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.135 -0.484 . . . . 72.13 111.082 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . 0.426 ' HE3' ' HA ' ' B' ' 310' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 73.35 110.904 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.938 0.399 . . . . 72.34 110.845 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 64.16 156.77 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 74.31 110.818 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 141' ' ' ASP . 6.0 m -50.86 118.62 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 74.1 111.092 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -136.75 85.34 2.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.471 . . . . 72.33 110.866 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 14.6 mttt . . . . . 0 C--N 1.329 -0.313 0 CA-C-O 121.519 0.676 . . . . 70.12 110.94 179.892 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 C--O 1.231 0.174 0 CA-C-O 120.707 0.211 . . . . 52.52 112.334 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.546 ' CH2' HD12 ' A' ' 149' ' ' LEU . 56.1 p-90 -81.88 -18.79 42.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.218 -0.446 . . . . 74.34 110.911 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -97.59 99.28 10.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.44 . . . . 74.51 110.889 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -75.99 -39.48 55.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 73.31 110.871 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 56.84 22.25 40.3 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 74.54 112.508 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.21 69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.773 0.32 . . . . 61.34 110.886 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.403 HG21 ' HB2' ' A' ' 92' ' ' ALA . 11.6 mm -133.12 144.44 36.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 72.4 111.125 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.458 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -98.18 168.89 9.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.15 -0.477 . . . . 73.01 111.105 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.458 ' H ' HG22 ' A' ' 88' ' ' THR . 5.5 ptm180 -58.93 -39.49 81.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.9 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -71.37 -35.62 71.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 74.02 110.963 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -72.93 -40.47 65.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.072 -0.513 . . . . 60.31 110.96 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.403 ' HB2' HG21 ' A' ' 87' ' ' ILE . . . -75.63 -33.74 60.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 73.04 111.138 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -61.67 -53.09 60.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.244 -0.434 . . . . 75.53 110.845 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -38.21 90.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.89 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.1 mt -55.62 -38.07 69.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.479 . . . . 72.23 110.967 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.658 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -100.0 43.27 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 73.44 110.933 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.498 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.62 -59.87 5.27 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.686 0.755 . . . . 63.13 110.942 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.2 Cg_endo -69.77 123.56 10.22 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.705 2.27 . . . . 72.51 112.332 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 116.87 4.76 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.719 2.28 . . . . 61.43 112.37 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -154.98 109.33 2.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 62.33 110.9 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.688 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.2 OUTLIER -62.09 111.64 2.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 52.44 111.164 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 131.03 -9.21 5.71 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.797 -0.716 . . . . 60.32 112.514 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -87.32 111.65 21.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.873 0.368 . . . . 74.2 110.885 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -123.59 163.63 20.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 74.22 110.908 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.653 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -160.45 135.74 7.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.16 -0.473 . . . . 72.44 110.917 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 87.8 t -109.97 137.04 44.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.236 -0.438 . . . . 70.44 111.063 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.7 ptt180 -150.15 144.4 25.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 71.54 110.867 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -54.9 125.71 21.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.484 . . . . 61.42 110.863 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.96 116.57 2.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 62.02 110.795 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.5 m -69.95 -29.88 67.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 63.34 111.111 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -102.53 0.35 33.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 73.53 110.881 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.428 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -139.7 94.88 9.04 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.657 0.742 . . . . 71.2 110.965 -179.925 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.7 Cg_endo -69.79 113.02 3.24 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.673 2.249 . . . . 75.52 112.354 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.8 -8.87 23.64 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.718 -0.753 . . . . 53.14 112.418 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.09 163.97 15.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.833 0.349 . . . . 75.11 110.87 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -118.32 160.08 22.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 60.33 110.953 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.6 m -137.02 127.94 27.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 72.01 111.141 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.58 125.06 46.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 73.42 110.973 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 17.9 t -109.24 124.26 50.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.225 -0.443 . . . . 71.34 110.899 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.1 t -123.5 153.39 29.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.471 . . . . 73.35 111.121 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.658 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -104.93 112.49 25.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 44.31 110.879 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.78 94.59 4.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.457 . . . . 54.45 110.926 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 67.16 29.67 7.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 60.5 110.971 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.74 -14.1 63.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.747 -0.739 . . . . 74.1 112.514 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.69 141.05 28.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 73.41 110.876 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.666 ' O ' HD13 ' B' ' 294' ' ' LEU . 9.0 m -100.83 111.1 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 74.44 111.149 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -102.23 123.97 46.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 74.1 110.854 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -101.15 132.18 46.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 71.31 110.902 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -116.17 122.73 45.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 61.12 110.921 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.579 ' O ' HG23 ' A' ' 140' ' ' ILE . 14.1 tpt180 -72.17 136.02 46.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 71.21 110.909 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 54.1 mt -117.74 107.08 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 74.04 111.137 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -83.0 128.78 34.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.448 . . . . 71.4 110.896 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.464 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.1 OUTLIER -113.7 103.04 10.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.442 . . . . 73.04 110.917 -179.852 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -140.85 142.64 34.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 73.24 110.847 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.72 39.6 24.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 71.34 111.095 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 56.96 25.15 10.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 64.53 110.864 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.8 mtmm -132.0 152.75 50.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 75.54 110.874 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.464 HD21 ' CE2' ' A' ' 133' ' ' TYR . 1.1 mt -115.86 150.49 36.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.434 . . . . 72.5 110.92 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 7.9 t -168.4 145.35 3.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 71.35 110.852 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.579 HG23 ' O ' ' A' ' 130' ' ' ARG . 35.4 mt -115.61 -32.09 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 74.42 111.089 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.482 ' CB ' HG21 ' B' ' 317' ' ' VAL . 36.8 t0 -89.37 1.61 55.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 70.21 110.8 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 60.31 18.18 7.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 72.55 110.852 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -132.22 -38.81 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 74.13 110.931 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.3 t -100.73 104.72 16.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 54.44 111.156 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -100.84 141.11 34.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 74.21 110.946 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . 0.463 ' CD1' HD12 ' A' ' 152' ' ' LEU . 52.0 m-85 -116.66 173.97 6.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 72.34 110.85 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.28 -17.56 22.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.094 -0.503 . . . . 74.24 110.941 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -170.49 158.71 6.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.08 -0.509 . . . . 62.21 110.877 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.546 HD12 ' CH2' ' A' ' 82' ' ' TRP . 0.0 OUTLIER -53.05 -39.42 63.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 63.52 110.925 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.9 ttt -51.29 -47.92 62.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 72.54 110.858 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -68.23 -41.59 81.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.918 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.463 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.8 OUTLIER -55.93 -48.56 75.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 71.44 110.905 -179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.511 HG21 ' CH2' ' A' ' 82' ' ' TRP . 87.9 t -61.81 -40.23 86.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 74.21 111.165 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -56.67 -38.44 72.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.493 . . . . 74.52 110.864 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -51.13 25.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 65.35 110.821 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.464 ' CD1' HD13 ' A' ' 163' ' ' LEU . 36.2 m-85 -64.28 -20.94 66.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 72.43 110.925 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.511 ' OG1' HD12 ' A' ' 167' ' ' LEU . 85.1 m -84.44 -29.48 26.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.118 -0.492 . . . . 71.02 111.122 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 89.0 m -79.44 -24.24 42.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.429 . . . . 64.43 111.167 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -162.54 166.15 25.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 70.41 110.907 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.89 -55.62 16.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 74.53 111.121 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 59.03 21.62 9.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.282 -0.417 . . . . 65.3 110.837 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 107.62 13.66 19.88 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.76 -0.733 . . . . 62.22 112.544 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.464 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.9 mp -108.15 136.25 48.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.882 0.372 . . . . 71.1 110.891 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 26.3 t -51.48 -30.25 19.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 70.05 110.942 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.46 ' HB ' HG22 ' A' ' 101' ' ' THR . 2.9 t -151.65 119.39 6.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 64.02 111.195 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.76 153.24 2.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.256 -0.429 . . . . 75.43 110.953 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.511 HD12 ' OG1' ' A' ' 157' ' ' THR . 6.3 mt -69.44 133.44 47.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.431 . . . . 70.13 110.996 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.688 HD12 ' O ' ' A' ' 101' ' ' THR . 22.4 mt -127.2 -51.23 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 65.31 111.158 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt -126.2 118.92 23.51 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.579 0.704 . . . . 72.43 110.892 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 131.91 22.31 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.712 2.275 . . . . 73.22 112.375 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 83.67 0.53 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 73.3 110.872 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 31.6 m -64.71 144.92 14.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.44 . . . . 75.23 111.162 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 52.41 110.872 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.666 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.729 0.3 . . . . 72.45 110.994 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 11.1 p -105.35 88.61 2.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 75.34 110.809 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -81.63 151.13 27.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.141 -0.481 . . . . 75.02 110.973 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . 0.426 ' O ' ' HE1' ' B' ' 313' ' ' MET . 0.0 OUTLIER -148.2 129.22 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 71.31 110.855 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.08 159.28 15.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 70.52 110.831 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 45.4 mtt180 -60.15 -18.48 47.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.094 -0.503 . . . . 71.5 110.873 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.05 -43.41 87.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 74.04 110.863 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.37 -23.18 17.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 70.12 110.918 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.408 ' HB2' HD11 ' B' ' 305' ' ' LEU . 53.6 m-20 -144.52 77.45 13.82 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.624 0.726 . . . . 73.03 110.819 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.84 -5.8 17.12 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.703 2.268 . . . . 44.44 112.3 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.3 t -92.63 27.52 2.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.232 -0.44 . . . . 72.0 111.207 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.408 HD11 ' HB2' ' B' ' 302' ' ' ASP . 24.4 mt -103.92 136.71 43.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 73.25 110.88 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.638 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.1 t -104.5 171.99 7.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 73.02 111.149 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -49.35 -36.82 22.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.272 -0.422 . . . . 74.43 110.885 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.86 -52.08 66.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.197 -0.456 . . . . 73.23 110.932 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.638 ' HG2' HG22 ' B' ' 306' ' ' THR . 18.8 mm-40 -64.15 -52.56 58.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.474 . . . . 71.34 110.932 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.473 HD13 ' HE2' ' B' ' 313' ' ' MET . 48.0 mm -55.85 -54.52 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 74.51 111.208 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 33.3 t -59.43 -21.38 59.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 73.43 110.872 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.14 3.9 25.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 72.25 111.143 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . 0.473 ' HE2' HD13 ' B' ' 310' ' ' ILE . 1.2 mtm . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 63.52 110.87 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.457 -0.094 0 CA-C-O 120.935 0.397 . . . . 53.24 110.868 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.4 m 66.49 136.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 75.31 110.922 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.482 HG21 ' CB ' ' A' ' 141' ' ' ASP . 5.8 m -51.25 121.97 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 72.45 111.142 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -128.4 78.41 1.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 64.53 110.86 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 23.7 mtmt . . . . . 0 C--N 1.329 -0.318 0 CA-C-O 121.655 0.74 . . . . 63.41 110.844 179.936 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.174 0 CA-C-O 120.711 0.213 . . . . 72.21 112.272 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.456 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 38.9 p-90 -101.57 -30.51 11.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 74.24 110.909 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -86.41 99.09 11.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.41 . . . . 74.13 110.886 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -76.56 -40.39 49.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 71.11 110.903 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.83 24.86 54.98 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 75.23 112.506 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.96 66.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.743 0.306 . . . . 74.33 110.899 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 14.2 mm -129.74 144.32 38.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 55.21 111.131 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.465 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -95.49 170.49 9.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 45.41 111.105 179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.465 ' H ' HG22 ' A' ' 88' ' ' THR . 1.9 ppt_? -60.9 -39.45 89.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 73.45 110.82 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -74.05 -33.78 63.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 73.33 110.9 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -70.82 -40.83 72.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 74.14 110.926 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.468 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -75.18 -34.13 61.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 45.04 111.135 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -60.07 -52.98 63.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 62.34 110.861 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.75 -36.35 82.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 75.43 110.929 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 92' ' ' ALA . 11.1 mt -55.01 -38.26 67.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.131 -0.486 . . . . 72.43 110.92 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.69 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.6 mm? -102.03 43.76 1.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 71.34 110.929 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.502 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.54 -59.68 6.67 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.631 0.729 . . . . 71.43 110.897 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.81 123.61 10.25 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.64 2.227 . . . . 75.23 112.373 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 116.82 4.74 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.674 2.249 . . . . 51.44 112.351 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -154.87 115.16 3.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 72.35 110.939 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.685 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.4 OUTLIER -66.6 111.69 3.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.166 -0.47 . . . . 73.52 111.165 -179.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.19 -5.07 6.37 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.705 -0.759 . . . . 74.05 112.44 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.428 HD12 ' O ' ' A' ' 169' ' ' LYS . 2.9 tp -90.6 113.15 25.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.838 0.352 . . . . 72.21 110.894 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.653 ' HB2' HD11 ' A' ' 118' ' ' LEU . 16.6 p90 -124.38 168.42 13.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 73.4 110.875 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.599 HD23 HD21 ' A' ' 96' ' ' LEU . 0.7 OUTLIER -164.03 137.14 5.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 64.32 110.934 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.485 HG11 HD22 ' A' ' 149' ' ' LEU . 89.5 t -110.65 135.73 48.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 72.44 111.164 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -149.3 143.01 25.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 70.31 110.866 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -54.88 124.08 15.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.181 -0.463 . . . . 62.52 110.885 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.2 m -56.37 115.91 2.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.078 -0.51 . . . . 74.02 110.855 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.4 m -68.61 -56.28 8.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 62.11 111.13 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.409 ' ND2' HG23 ' B' ' 310' ' ' ILE . 26.0 p30 -68.19 -19.55 64.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 71.42 110.963 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.429 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 1.3 m-85 -124.75 93.15 46.61 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.673 0.749 . . . . 74.15 110.934 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 54.0 Cg_endo -69.71 119.84 6.72 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.668 2.245 . . . . 72.34 112.409 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.73 -10.45 23.42 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.792 -0.718 . . . . 62.43 112.473 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -119.46 -178.61 3.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.802 0.334 . . . . 71.11 110.838 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -130.59 162.15 29.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 70.43 110.885 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 96.4 m -130.32 125.33 34.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.111 -0.495 . . . . 63.12 111.195 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.653 HD11 ' HB2' ' A' ' 104' ' ' PHE . 30.2 tp -98.57 112.6 24.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.277 -0.419 . . . . 74.35 110.881 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.1 m -101.04 126.35 47.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 72.0 110.877 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.524 HG21 ' CD1' ' A' ' 163' ' ' LEU . 11.7 t -127.55 151.21 34.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 53.54 111.116 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.69 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -100.27 112.62 24.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 70.55 110.845 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.96 94.27 4.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 72.0 110.909 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 65.58 25.52 11.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.03 110.897 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.9 8.85 55.19 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 51.03 112.535 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -110.55 139.09 46.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.768 0.318 . . . . 64.32 110.874 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.607 ' O ' HD13 ' B' ' 294' ' ' LEU . 69.3 t -95.17 101.21 12.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 73.03 111.162 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -90.24 110.23 21.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 73.55 110.88 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -89.03 124.52 34.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 60.2 110.84 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.53 ' HB3' HD13 ' A' ' 140' ' ' ILE . 66.3 m-85 -113.93 104.49 12.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 62.21 110.908 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -53.76 133.66 42.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.08 -0.509 . . . . 70.44 110.845 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 65.2 mt -113.13 106.95 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.456 . . . . 63.21 111.153 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.1 ttm -76.69 129.31 36.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 63.22 110.942 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -114.88 115.97 27.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 74.03 110.972 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -149.58 137.03 20.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 64.11 110.869 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.46 36.11 24.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 62.52 111.101 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.57 25.41 14.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 73.01 110.813 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -126.24 144.02 50.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 71.31 110.892 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.9 mp -106.5 150.7 25.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.258 -0.428 . . . . 73.42 110.913 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -168.26 134.84 2.0 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.184 -0.462 . . . . 72.51 110.855 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.597 ' CG2' HG13 ' B' ' 317' ' ' VAL . 50.0 mt -110.77 -33.48 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 74.34 111.138 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.789 ' HB3' HG21 ' B' ' 317' ' ' VAL . 3.4 p30 -95.48 9.8 38.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.114 -0.494 . . . . 74.13 110.864 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 6.7 pt-20 45.48 31.29 0.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.54 110.973 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -131.86 -39.47 1.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.079 -0.51 . . . . 70.43 110.86 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.527 HG12 ' OD1' ' A' ' 141' ' ' ASP . 2.7 p -118.52 104.55 16.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 64.43 111.136 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -91.91 149.83 21.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 74.22 110.891 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -120.09 173.76 6.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 64.05 110.887 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -93.84 -18.19 22.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 52.25 110.886 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -172.05 158.7 4.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 64.11 110.888 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.485 HD22 HG11 ' A' ' 106' ' ' VAL . 0.6 OUTLIER -51.19 -36.02 39.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 74.44 110.881 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.5 ttt -52.47 -51.14 60.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 63.44 110.928 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -65.99 -40.05 90.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 72.15 110.951 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.71 -49.71 72.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.212 -0.449 . . . . 73.21 110.927 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.64 HG13 HD12 ' A' ' 167' ' ' LEU . 96.5 t -59.04 -44.62 91.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 72.14 111.18 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -52.97 -38.99 62.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.102 -0.499 . . . . 70.55 110.837 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -53.43 16.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 62.24 110.882 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.73 ' CE1' HD23 ' A' ' 163' ' ' LEU . 51.4 m-85 -62.65 -17.27 60.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 55.54 110.896 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 99.6 m -85.83 -32.46 21.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 70.12 111.15 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 16.2 m -79.68 -22.49 43.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 74.24 111.17 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -165.88 161.68 17.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 75.4 110.893 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.31 -58.35 6.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 72.52 111.108 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.01 16.6 9.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.256 -0.429 . . . . 52.51 110.873 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 115.3 1.45 21.95 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.695 -0.764 . . . . 62.51 112.467 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.73 HD23 ' CE1' ' A' ' 156' ' ' TYR . 0.9 OUTLIER -93.41 140.39 29.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.801 0.334 . . . . 72.01 110.889 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 34.6 t -51.06 -30.56 16.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.201 -0.454 . . . . 73.12 110.848 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.6 t -158.66 125.11 4.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.246 -0.434 . . . . 55.14 111.183 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -50.77 146.22 6.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 74.44 110.857 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.64 HD12 HG13 ' A' ' 153' ' ' VAL . 7.3 mt -65.04 134.78 54.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 74.31 110.899 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.685 HD12 ' O ' ' A' ' 101' ' ' THR . 25.1 mt -127.13 -51.17 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 52.33 111.11 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . 0.428 ' O ' HD12 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -127.77 118.82 21.19 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.556 0.693 . . . . 63.3 110.904 179.838 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 141.96 46.81 Favored 'Trans proline' 0 C--O 1.232 0.215 0 C-N-CA 122.724 2.283 . . . . 64.01 112.375 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . 0.416 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -70.63 82.51 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.237 -0.438 . . . . 50.52 110.923 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 13.5 m -65.0 124.76 20.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 75.1 111.124 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.2 ptm . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 74.22 110.887 179.911 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.607 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.731 0.3 . . . . 72.42 110.94 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.2 t -96.65 88.64 4.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.161 -0.472 . . . . 63.35 110.885 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -77.66 147.87 35.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.495 . . . . 73.21 110.904 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -151.39 129.54 11.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 72.24 110.929 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.84 175.0 5.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 62.41 110.843 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 36.4 mtt180 -64.24 -15.5 60.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.094 -0.503 . . . . 70.44 110.842 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.16 -42.75 99.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 75.03 110.836 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -102.43 -10.75 19.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.165 -0.47 . . . . 74.32 110.931 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.525 ' HB2' HD11 ' B' ' 305' ' ' LEU . 10.4 m-20 -156.83 77.62 4.06 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.592 0.71 . . . . 72.42 110.862 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -6.26 18.18 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.712 2.275 . . . . 63.05 112.337 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.8 t -93.31 27.15 2.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 75.34 111.135 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.525 HD11 ' HB2' ' B' ' 302' ' ' ASP . 34.8 mt -103.98 136.84 42.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 74.11 110.947 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.615 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.7 t -103.4 174.24 5.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 42.04 111.13 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -49.87 -34.37 19.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 73.04 110.895 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . 0.443 ' H ' HG23 ' B' ' 306' ' ' THR . 4.0 tp10 -64.95 -48.95 72.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.482 . . . . 71.54 110.921 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.615 ' HG2' HG22 ' B' ' 306' ' ' THR . 21.3 mm-40 -64.89 -52.22 57.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.074 -0.512 . . . . 75.43 110.872 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.409 HG23 ' ND2' ' A' ' 111' ' ' ASN . 43.9 mm -57.17 -53.28 45.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 72.22 111.145 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 46.8 m -63.67 -18.44 63.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 64.52 110.792 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.38 2.99 29.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 62.24 111.168 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.7 mtt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 62.42 110.925 179.952 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 13.2 p . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.914 0.388 . . . . 73.12 110.903 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 62.86 161.56 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.098 -0.501 . . . . 53.42 110.814 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.789 HG21 ' HB3' ' A' ' 141' ' ' ASP . 15.3 m -68.6 134.47 30.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.108 -0.497 . . . . 62.2 111.15 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -132.14 74.38 1.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 73.02 110.91 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 34.1 mttt . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.595 0.712 . . . . 72.05 110.876 179.878 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.783 0.243 . . . . 74.04 112.325 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.437 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 39.0 p-90 -102.86 -31.01 10.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.271 -0.422 . . . . 75.34 110.892 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -86.44 102.06 13.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.24 110.893 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -76.25 -36.63 58.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 61.31 110.891 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.39 18.75 37.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.736 -0.745 . . . . 40.25 112.554 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.51 78.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 64.53 110.872 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.498 HG21 ' HB2' ' A' ' 92' ' ' ALA . 13.4 mm -139.21 144.28 29.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 75.2 111.103 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.449 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -96.11 176.01 6.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.103 -0.499 . . . . 75.52 111.195 179.933 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.449 ' H ' HG22 ' A' ' 88' ' ' THR . 5.5 ppt_? -65.44 -39.12 91.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.224 -0.444 . . . . 74.43 110.908 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -74.61 -33.07 62.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.165 -0.47 . . . . 62.4 110.883 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -71.77 -43.06 66.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 75.01 110.878 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.498 ' HB2' HG21 ' A' ' 87' ' ' ILE . . . -75.04 -33.82 61.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 65.54 111.126 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -60.25 -53.28 59.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 63.33 110.892 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -36.58 83.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.489 . . . . 72.25 110.892 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' A' ' 92' ' ' ALA . 12.0 mt -55.01 -38.18 67.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.188 -0.46 . . . . 45.23 110.88 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.676 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.2 mm? -102.03 43.75 1.05 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.228 -0.442 . . . . 71.01 110.917 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.62 -59.91 6.27 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.679 0.752 . . . . 74.44 110.975 179.933 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.7 Cg_endo -69.83 123.25 9.89 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.631 2.22 . . . . 73.33 112.326 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 117.58 5.17 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.677 2.251 . . . . 71.45 112.331 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -154.81 108.17 2.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.176 -0.465 . . . . 61.11 110.905 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.659 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -60.79 112.79 2.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 74.22 111.19 -179.923 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.09 -6.9 6.39 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.745 -0.741 . . . . 63.44 112.495 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.13 115.44 27.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.855 0.36 . . . . 72.14 110.924 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -126.77 164.36 21.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 74.01 110.882 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.587 HD23 HD21 ' A' ' 96' ' ' LEU . 0.7 OUTLIER -161.13 137.93 8.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 72.3 110.879 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.437 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 92.3 t -110.3 140.27 30.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 65.04 111.08 179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -153.15 145.58 24.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 73.11 110.866 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.53 125.02 13.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 72.14 110.895 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.5 m -58.38 113.19 1.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 72.34 110.774 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.58 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.9 m -68.92 -56.27 8.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 63.24 111.097 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.637 ' CG ' HD12 ' B' ' 310' ' ' ILE . 34.2 m-80 -65.02 -27.88 69.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 63.23 110.917 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -117.64 94.62 46.2 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.675 0.75 . . . . 72.25 110.927 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 118.09 5.48 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.656 2.237 . . . . 64.21 112.338 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.57 -1.32 24.85 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.757 -0.735 . . . . 54.1 112.485 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -129.06 -173.41 2.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.799 0.333 . . . . 70.11 110.872 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -134.52 166.61 22.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.88 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 57.6 m -138.38 141.6 39.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.098 -0.501 . . . . 64.04 111.14 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.591 ' CD2' HD11 ' A' ' 163' ' ' LEU . 0.4 OUTLIER -110.96 118.23 35.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 75.32 110.949 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.5 m -101.59 125.92 48.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.44 . . . . 72.53 110.892 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.412 HG21 HD12 ' A' ' 163' ' ' LEU . 15.4 t -126.1 150.91 31.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 63.44 111.12 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.676 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.99 111.64 24.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.42 110.878 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.73 93.11 3.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.475 . . . . 75.24 110.931 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 66.81 29.8 8.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 74.34 110.936 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.9 -14.0 63.17 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.763 -0.732 . . . . 74.43 112.508 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -88.14 139.29 30.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 71.23 110.919 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.647 ' O ' HD13 ' B' ' 294' ' ' LEU . 95.6 t -100.09 111.27 29.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.138 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.541 ' OE2' HD11 ' B' ' 294' ' ' LEU . 5.0 mm-40 -100.96 124.18 46.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 61.14 110.928 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -101.6 124.76 47.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 74.41 110.825 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.61 ' CE1' HD13 ' A' ' 163' ' ' LEU . 72.9 m-85 -112.3 112.73 24.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.467 . . . . 71.33 110.968 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -62.2 139.27 58.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 63.51 110.883 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.456 ' CG2' HD23 ' A' ' 138' ' ' LEU . 60.2 mt -119.69 109.61 26.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 72.14 111.104 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.38 123.29 30.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 64.32 110.89 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.481 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -112.4 98.23 7.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 72.44 110.951 -179.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -131.47 142.61 50.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 74.5 110.865 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.65 36.1 26.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 64.31 111.113 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.51 26.44 16.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 60.42 110.872 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -131.34 139.33 49.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 71.3 110.907 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.481 HD21 ' CE2' ' A' ' 133' ' ' TYR . 4.0 mp -102.08 150.46 23.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.465 . . . . 74.31 110.93 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -167.79 138.37 2.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.875 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.561 HG22 HG13 ' B' ' 317' ' ' VAL . 50.3 mt -112.93 -34.87 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 73.13 111.071 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.616 ' HB3' HG21 ' B' ' 317' ' ' VAL . 7.6 p30 -89.14 -1.67 58.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.254 -0.43 . . . . 65.13 110.853 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 61.12 17.49 8.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 73.21 110.805 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -127.21 -33.36 2.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.22 110.915 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -113.36 104.86 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 71.43 111.103 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -97.19 145.65 25.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 73.51 111.009 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . 0.448 ' CD1' HD12 ' A' ' 152' ' ' LEU . 53.8 m-85 -118.52 178.1 4.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 74.41 110.806 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.68 -15.63 17.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.112 -0.495 . . . . 74.34 110.912 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -165.48 172.2 12.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 74.24 110.871 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.405 ' H ' HD12 ' A' ' 149' ' ' LEU . 0.6 OUTLIER -74.71 -23.88 58.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 75.11 110.901 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -57.19 11.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 65.03 110.866 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -65.08 -35.33 80.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 73.31 110.908 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.448 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.57 -47.57 76.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.43 110.929 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.472 HG13 HD12 ' A' ' 167' ' ' LEU . 75.2 t -64.99 -39.48 85.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 54.23 111.142 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -54.43 -37.83 65.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.109 -0.496 . . . . 74.24 110.958 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.03 -44.84 62.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.107 -0.497 . . . . 72.4 110.88 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.474 ' CE1' HD23 ' A' ' 163' ' ' LEU . 38.3 m-85 -67.96 -22.09 65.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.451 . . . . 75.2 110.898 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.496 HG23 ' O ' ' A' ' 167' ' ' LEU . 55.5 m -84.24 -30.04 26.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 61.53 111.164 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 19.2 m -78.96 -25.83 43.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.213 -0.449 . . . . 62.4 111.118 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.66 161.68 29.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.194 -0.457 . . . . 41.21 110.868 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.1 -58.32 6.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.419 . . . . 43.5 111.103 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 60.2 19.51 8.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.459 . . . . 72.41 110.907 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 114.43 0.76 23.44 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.696 -0.764 . . . . 73.54 112.449 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.61 HD13 ' CE1' ' A' ' 129' ' ' TYR . 3.0 mm? -93.83 139.2 31.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.888 0.375 . . . . 75.41 110.918 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 36.0 t -51.27 -30.29 17.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 74.12 110.822 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.1 t -156.42 125.7 6.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 42.02 111.137 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -50.73 142.22 11.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.227 -0.442 . . . . 74.34 110.819 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.496 ' O ' HG23 ' A' ' 157' ' ' THR . 8.6 mt -64.31 134.62 55.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.14 -0.482 . . . . 64.22 110.847 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.659 HD12 ' O ' ' A' ' 101' ' ' THR . 28.8 mt -121.77 -51.25 3.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 71.42 111.112 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -132.42 126.36 20.19 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.595 0.712 . . . . 74.12 110.887 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.85 140.58 42.69 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.662 2.241 . . . . 64.44 112.343 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.09 83.48 0.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.274 -0.421 . . . . 75.35 110.931 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 29.1 m -64.46 129.91 28.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 71.44 111.173 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.4 ptt? . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 52.23 110.899 179.949 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.647 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.793 0.33 . . . . 74.22 110.926 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.91 88.5 2.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 70.53 110.801 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -74.63 149.23 40.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.153 -0.476 . . . . 75.23 110.92 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . 0.407 ' O ' ' HE1' ' B' ' 313' ' ' MET . 0.4 OUTLIER -144.55 129.09 18.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.106 -0.497 . . . . 75.13 110.904 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . 0.58 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -91.79 157.02 17.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 73.41 110.852 -179.919 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -59.31 -18.94 42.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.093 -0.503 . . . . 74.13 110.869 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -36.65 84.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 72.4 110.85 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -97.7 -24.55 15.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 72.12 110.893 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.428 ' HB2' HD11 ' B' ' 305' ' ' LEU . 9.2 m-20 -144.59 79.21 12.59 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.677 0.751 . . . . 54.2 110.915 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 -5.83 17.19 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.617 2.211 . . . . 61.25 112.326 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.0 t -93.24 27.43 2.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 74.24 111.145 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.428 HD11 ' HB2' ' B' ' 302' ' ' ASP . 29.2 mt -101.31 136.83 40.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.235 -0.439 . . . . 75.15 110.981 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.638 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.2 t -105.95 172.81 6.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 75.14 111.118 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -49.43 -37.34 25.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 63.31 110.924 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -60.75 -52.43 65.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 74.14 110.85 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.638 ' HG2' HG22 ' B' ' 306' ' ' THR . 10.0 mm-40 -63.64 -52.39 60.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.475 . . . . 70.12 110.915 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.637 HD12 ' CG ' ' A' ' 111' ' ' ASN . 43.3 mm -55.83 -53.77 34.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 73.3 111.171 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 7.8 t -58.67 -22.84 58.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 72.11 110.855 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.54 4.28 25.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 64.42 111.054 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . 0.626 ' HE2' HD13 ' B' ' 310' ' ' ILE . 1.4 mtm . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 70.41 110.894 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 21.2 p . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.897 0.38 . . . . 70.05 110.829 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 66.65 130.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 73.44 110.853 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.616 HG21 ' HB3' ' A' ' 141' ' ' ASP . 6.0 m -50.22 133.51 10.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 65.13 111.112 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.49 74.48 1.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 71.14 110.892 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.8 mttp . . . . . 0 C--N 1.329 -0.316 0 CA-C-O 121.627 0.727 . . . . 74.54 110.911 179.872 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.23 0.119 0 CA-C-O 120.735 0.223 . . . . 65.11 112.283 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.448 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 32.4 p-90 -101.51 -30.73 11.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.439 . . . . 74.44 110.888 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -89.91 108.1 19.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.419 . . . . 71.43 110.936 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 17.7 m-70 -83.44 -46.97 11.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 50.12 110.891 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.89 33.0 71.57 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.707 -0.759 . . . . 54.3 112.538 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.61 33.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.712 0.292 . . . . 65.2 110.922 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.4 HG21 ' HB2' ' A' ' 92' ' ' ALA . 7.4 mm -103.3 144.07 14.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.42 111.072 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.19 159.35 16.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.125 -0.488 . . . . 73.12 111.213 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -54.14 -37.94 64.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 74.33 110.904 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -77.15 -32.05 56.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.232 -0.44 . . . . 73.03 110.829 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -70.09 -39.49 75.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 72.03 110.915 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.472 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -74.99 -35.99 62.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 70.5 111.151 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -58.87 -52.85 63.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 34.21 110.927 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.75 -35.63 80.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.495 . . . . 72.2 110.862 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 92' ' ' ALA . 11.5 mt -54.9 -38.49 67.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 74.54 110.926 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.701 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -98.46 43.67 1.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 64.02 110.949 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.503 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.72 -59.92 6.15 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.622 0.725 . . . . 75.34 110.912 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.9 Cg_endo -69.68 123.35 10.04 Favored 'Trans proline' 0 N--CA 1.465 -0.195 0 C-N-CA 122.73 2.287 . . . . 73.04 112.347 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 117.67 5.22 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.68 2.254 . . . . 75.31 112.333 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.9 105.29 2.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.217 -0.447 . . . . 73.4 110.862 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.691 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.0 OUTLIER -58.64 111.9 1.42 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.127 -0.488 . . . . 63.14 111.11 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.32 -5.09 6.32 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.718 -0.753 . . . . 64.11 112.511 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.31 117.49 29.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.876 0.37 . . . . 74.23 110.924 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.503 ' HB3' HD22 ' A' ' 167' ' ' LEU . 23.9 p90 -128.5 166.79 18.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.164 -0.471 . . . . 72.31 110.885 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.651 HD23 HD21 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -164.23 138.72 5.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 74.41 110.874 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.448 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 92.9 t -109.92 131.19 61.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 71.12 111.211 179.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.26 145.71 41.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 71.2 110.879 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.76 123.92 8.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 74.14 110.893 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.5 m -62.16 109.3 1.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 51.42 110.856 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.584 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.5 m -68.69 -56.31 8.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 73.33 111.167 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.54 ' CG ' HD12 ' B' ' 310' ' ' ILE . 67.2 m-80 -64.38 -27.04 68.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.196 -0.457 . . . . 65.12 110.823 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.413 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 2.4 m-85 -118.43 95.73 49.03 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.677 0.751 . . . . 65.2 110.869 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.6 Cg_endo -69.77 114.34 3.67 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.638 2.225 . . . . 61.24 112.368 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.41 -1.18 25.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.729 -0.748 . . . . 72.0 112.532 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -123.47 -172.97 2.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.789 0.328 . . . . 72.51 110.832 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -139.98 145.12 37.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.904 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.4 m -113.6 141.63 46.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 63.4 111.136 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.529 ' CD2' HD11 ' A' ' 163' ' ' LEU . 0.4 OUTLIER -113.14 118.97 36.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.244 -0.434 . . . . 44.4 110.913 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 14.7 t -102.66 129.94 49.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.445 . . . . 73.24 110.85 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.419 HG21 HD12 ' A' ' 163' ' ' LEU . 11.7 t -128.53 150.01 33.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.03 111.092 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.701 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.12 112.45 25.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 74.41 110.895 -179.828 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.13 91.46 3.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.116 -0.493 . . . . 62.14 110.862 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 66.35 32.21 7.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 73.0 110.896 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.34 -13.76 64.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.712 -0.756 . . . . 54.14 112.476 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.03 145.69 25.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.833 0.349 . . . . 70.32 110.909 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.485 ' O ' HD13 ' B' ' 294' ' ' LEU . 6.8 m -106.08 116.38 49.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 63.42 111.166 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -107.28 122.8 47.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 74.53 110.822 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -99.78 124.16 44.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 62.32 110.804 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.635 ' CE1' HD13 ' A' ' 163' ' ' LEU . 56.4 m-85 -110.8 116.99 32.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 54.14 110.881 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 129.73 40.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 75.55 110.78 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.497 HG12 HD11 ' A' ' 140' ' ' ILE . 33.3 mt -113.66 109.41 28.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 45.33 111.153 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -81.41 125.22 30.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 31.23 110.913 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.46 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.97 101.06 8.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.261 -0.427 . . . . 73.53 110.907 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -137.36 142.55 41.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 74.11 110.894 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.66 35.87 24.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 73.54 111.158 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 2.7 t 60.26 31.87 20.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 62.44 110.795 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mtmm -137.92 142.56 40.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.174 -0.466 . . . . 74.32 110.884 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.46 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 4.4 mp -105.64 152.2 23.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 70.41 110.929 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -169.59 139.94 2.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.449 . . . . 73.45 110.816 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.524 ' CG2' HG13 ' B' ' 317' ' ' VAL . 58.4 mt -115.65 -37.14 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 74.33 111.145 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.65 ' HB3' HG21 ' B' ' 317' ' ' VAL . 23.6 p30 -89.19 -5.26 57.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 75.13 110.915 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 61.98 15.87 7.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 62.14 110.901 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -123.79 -9.19 7.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.074 -0.512 . . . . 74.24 110.896 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.5 t -143.48 104.53 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.101 -0.5 . . . . 62.52 111.073 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -94.99 145.47 24.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 53.12 110.89 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . 0.432 ' CD1' HD12 ' A' ' 152' ' ' LEU . 49.3 m-85 -117.09 178.05 4.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 73.32 110.869 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.68 -15.69 17.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 64.54 110.92 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.429 ' C ' HD13 ' A' ' 138' ' ' LEU . 1.5 t30 -165.76 172.07 12.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 71.33 110.849 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.5 -23.26 58.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 62.22 110.894 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.5 ttp -62.55 -57.19 12.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 63.42 110.864 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -65.73 -35.66 81.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.456 . . . . 71.11 110.97 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.432 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.54 -48.46 74.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.466 . . . . 64.31 110.958 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.77 HG13 HD12 ' A' ' 167' ' ' LEU . 71.0 t -64.79 -38.01 81.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.489 . . . . 75.12 111.124 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -55.4 -38.32 68.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 73.42 110.904 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -72.22 -45.2 61.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.43 110.826 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.526 ' CD1' HD23 ' A' ' 163' ' ' LEU . 32.5 m-85 -69.92 -15.82 63.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 75.1 110.968 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.421 HG23 ' O ' ' A' ' 167' ' ' LEU . 96.8 m -86.96 -34.16 19.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.079 -0.509 . . . . 74.32 111.128 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.5 t -80.09 -23.45 41.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 60.04 111.164 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.25 153.65 24.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 64.12 110.855 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.51 -58.16 7.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 41.53 111.116 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 56.21 25.19 8.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 55.2 110.928 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 119.28 -11.3 11.5 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.742 -0.742 . . . . 71.42 112.483 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.635 HD13 ' CE1' ' A' ' 129' ' ' TYR . 3.8 mm? -86.93 138.38 31.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.896 0.379 . . . . 70.32 110.894 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 19.5 t -51.23 -29.51 14.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.141 -0.481 . . . . 72.02 110.856 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.467 HG21 HG22 ' A' ' 101' ' ' THR . 4.5 t -158.99 128.13 5.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 72.4 111.095 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -51.62 139.53 20.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 73.21 110.928 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.77 HD12 HG13 ' A' ' 153' ' ' VAL . 8.5 mt -60.95 139.54 58.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.258 -0.428 . . . . 65.24 110.874 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.691 HD12 ' O ' ' A' ' 101' ' ' THR . 26.4 mt -127.13 -51.5 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 53.51 111.148 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -128.15 122.04 21.94 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.578 0.704 . . . . 72.22 110.932 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 138.45 37.99 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.753 2.302 . . . . 72.52 112.329 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.42 84.03 0.4 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 61.42 110.899 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 28.7 m -64.38 138.52 22.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.438 . . . . 71.52 111.174 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.1 ptm . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 75.45 110.844 179.992 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.485 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.774 0.321 . . . . 65.52 110.899 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 4.4 p -96.72 88.88 4.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 61.24 110.859 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -77.0 145.64 37.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.11 -0.495 . . . . 73.55 110.962 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -136.7 129.58 30.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 63.34 110.888 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . 0.584 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -91.82 164.31 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.276 -0.42 . . . . 62.5 110.853 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 28.6 mtt180 -67.78 -12.47 60.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 61.42 110.889 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.23 -37.84 66.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 71.54 110.889 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -95.93 -16.84 21.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.139 -0.482 . . . . 73.23 110.904 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.531 ' HB2' HD11 ' B' ' 305' ' ' LEU . 31.5 m-20 -153.73 79.08 5.39 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.646 0.736 . . . . 70.2 110.912 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 -6.57 18.88 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.709 2.272 . . . . 60.04 112.33 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 15.3 t -93.78 27.24 2.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 43.44 111.113 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' B' ' 302' ' ' ASP . 44.5 mt -101.31 136.79 40.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.202 -0.454 . . . . 62.32 110.985 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.59 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.0 t -103.17 169.99 8.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 52.53 111.103 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -49.66 -32.5 13.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.21 110.856 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -63.98 -47.64 79.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 60.23 110.875 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.59 ' HG2' HG22 ' B' ' 306' ' ' THR . 3.4 mm-40 -65.34 -49.27 70.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 54.14 110.879 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.54 HD12 ' CG ' ' A' ' 111' ' ' ASN . 24.3 mm -61.54 -53.24 51.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 65.11 111.202 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 79.3 p -58.57 -23.39 58.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 73.04 110.855 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -78.79 -1.63 35.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.479 . . . . 60.02 111.062 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 74.43 110.931 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.816 0.341 . . . . 63.12 110.808 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 5.8 t 65.12 151.69 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 73.05 110.838 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.65 HG21 ' HB3' ' A' ' 141' ' ' ASP . 6.8 m -59.02 120.32 4.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.093 -0.503 . . . . 71.04 111.14 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -127.34 74.85 1.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 71.03 110.918 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 121.654 0.74 . . . . 74.23 110.881 179.925 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo . . . . . 0 N--CA 1.465 -0.163 0 CA-C-O 120.872 0.28 . . . . 71.11 112.379 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.469 ' CH2' HG21 ' A' ' 153' ' ' VAL . 37.0 p-90 -100.2 -25.99 14.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.465 . . . . 65.05 110.918 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -98.73 103.14 15.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.249 -0.432 . . . . 75.24 110.913 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -79.58 -45.43 19.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 65.11 110.938 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 60.82 35.31 89.88 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.699 -0.762 . . . . 60.02 112.497 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.3 34.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.743 0.306 . . . . 73.51 110.885 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.605 HG23 ' HB3' ' A' ' 91' ' ' GLN . 16.7 mm -109.19 144.96 16.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 72.21 111.133 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -97.76 177.5 5.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 72.22 111.141 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ppt_? -65.35 -40.7 93.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 65.24 110.872 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -38.06 89.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 65.2 110.889 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.605 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -76.11 -37.7 57.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 72.14 110.93 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.61 -36.26 78.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 71.42 111.089 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -67.83 -53.06 29.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.158 -0.474 . . . . 71.34 110.913 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.09 -35.0 79.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 72.42 110.82 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.17 -36.02 82.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 70.53 110.94 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.588 HD12 ' CB ' ' A' ' 121' ' ' SER . 2.6 mm? -103.19 43.44 1.08 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.18 -0.464 . . . . 71.41 110.951 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.494 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.27 -60.12 4.41 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.776 0.798 . . . . 73.42 110.914 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.74 123.32 9.99 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.627 2.218 . . . . 72.54 112.388 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.78 118.14 5.5 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.72 2.28 . . . . 63.34 112.297 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -155.01 111.08 3.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 73.01 110.884 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.631 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -63.16 112.69 2.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.068 -0.515 . . . . 65.32 111.154 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.97 -6.94 6.43 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.809 -0.71 . . . . 61.01 112.556 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.458 HD12 ' O ' ' A' ' 169' ' ' LYS . 2.4 tp -90.26 114.6 26.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.842 0.353 . . . . 75.03 110.835 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.667 ' HB3' HD22 ' A' ' 167' ' ' LEU . 20.2 p90 -126.24 164.34 21.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 74.33 110.927 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.586 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -161.24 136.45 7.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 63.13 110.928 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.432 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 86.2 t -110.19 132.84 57.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 72.34 111.161 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -142.3 149.96 40.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 73.12 110.846 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.22 124.05 15.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 72.53 110.911 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.8 m -60.02 112.6 1.94 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 61.24 110.857 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.9 m -68.68 -53.29 23.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 75.41 111.161 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.418 ' CG ' HD12 ' B' ' 310' ' ' ILE . 6.6 m-80 -63.86 -29.45 70.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 54.2 110.9 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -123.45 97.4 42.45 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.648 0.737 . . . . 72.15 110.983 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.68 123.85 10.54 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.654 2.236 . . . . 73.22 112.398 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.61 -14.99 22.26 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.763 -0.732 . . . . 74.43 112.453 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -116.15 -175.34 2.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.777 0.322 . . . . 62.44 110.809 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -135.92 156.63 48.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 71.15 110.95 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 92.3 m -128.05 131.06 49.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 54.14 111.173 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.01 124.36 43.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.288 -0.415 . . . . 72.41 110.988 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.9 t -108.44 125.79 52.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 64.05 110.89 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.1 t -124.86 151.57 30.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.24 111.195 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.588 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -101.9 111.24 23.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 74.14 110.818 -179.834 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.28 89.73 3.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 52.23 110.93 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 67.97 31.71 5.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 71.33 110.799 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.94 -14.48 62.71 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.738 -0.744 . . . . 74.32 112.515 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -88.09 139.79 30.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.839 0.352 . . . . 73.33 110.941 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.475 HG23 ' HB3' ' B' ' 294' ' ' LEU . 7.3 m -100.44 106.74 19.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 75.24 111.085 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -95.77 121.31 37.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 62.51 110.949 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -100.75 124.88 47.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 73.51 110.848 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -112.66 120.24 40.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.169 -0.469 . . . . 73.34 110.882 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -67.86 133.11 48.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.1 -0.5 . . . . 75.03 110.91 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 49.7 mt -117.34 107.63 22.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 73.32 111.129 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.6 ttm -83.01 123.34 29.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 74.25 110.888 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.467 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.07 100.8 8.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.312 -0.404 . . . . 73.11 110.949 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -136.36 142.5 43.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 75.4 110.801 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.17 35.99 25.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 75.52 111.114 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.4 t 60.33 29.76 19.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.239 -0.437 . . . . 72.1 110.811 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -136.31 140.99 43.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 74.14 110.873 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.581 HD21 ' HG ' ' A' ' 149' ' ' LEU . 5.0 mp -101.93 153.72 19.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 64.03 110.915 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.59 139.21 2.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.48 . . . . 71.21 110.863 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.449 HD12 ' CZ ' ' A' ' 156' ' ' TYR . 50.1 mt -115.5 -28.9 2.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 71.01 111.108 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -101.14 -5.32 25.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.161 -0.472 . . . . 71.03 110.873 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 63.63 14.62 8.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 70.32 110.835 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -119.42 -19.74 8.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.446 . . . . 74.03 110.918 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -133.7 104.3 6.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.108 -0.497 . . . . 64.53 111.128 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -94.04 144.87 25.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.218 -0.447 . . . . 75.24 110.9 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -113.04 175.08 5.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.124 -0.489 . . . . 73.11 110.874 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -96.02 -16.91 21.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.141 -0.481 . . . . 61.34 110.861 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -173.77 158.82 3.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 52.3 110.893 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.581 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.9 OUTLIER -51.5 -36.31 44.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 74.33 110.935 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.9 ttp -52.29 -51.39 58.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 52.5 110.902 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -66.0 -39.63 90.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 75.45 110.944 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.67 -53.41 56.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 74.14 110.907 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.509 HG13 HD12 ' A' ' 167' ' ' LEU . 69.4 t -61.5 -36.7 74.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 74.11 111.118 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -54.99 -40.27 69.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 74.03 110.903 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.21 -52.3 17.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 73.14 110.891 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.676 ' CD1' HD13 ' A' ' 163' ' ' LEU . 63.1 m-85 -62.72 -17.15 60.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 74.34 110.94 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.3 m -87.44 -32.79 19.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.085 -0.507 . . . . 63.03 111.126 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 19.3 m -77.46 -21.56 52.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.254 -0.43 . . . . 72.23 111.182 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.74 176.35 4.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 74.32 110.832 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.88 -58.13 6.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 65.14 111.111 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.81 19.68 8.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 72.15 110.855 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . 0.846 ' HA3' HG23 ' B' ' 317' ' ' VAL . . . 116.66 -8.45 17.14 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.742 -0.742 . . . . 64.41 112.423 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.676 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.1 mp -94.5 148.06 22.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.863 0.363 . . . . 75.23 110.869 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 22.1 p -54.35 -27.25 34.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 75.32 110.983 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.504 HG21 HG22 ' A' ' 101' ' ' THR . 14.7 t -159.55 133.74 7.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.126 -0.488 . . . . 62.55 111.101 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.3 ptt-85 -53.93 173.14 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 72.33 110.91 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.667 HD22 ' HB3' ' A' ' 104' ' ' PHE . 15.0 mt -93.82 141.73 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 71.51 110.895 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.631 HD12 ' O ' ' A' ' 101' ' ' THR . 30.4 mt -125.41 -51.19 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.194 -0.457 . . . . 64.23 111.213 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . 0.458 ' O ' HD12 ' A' ' 103' ' ' LEU . 8.3 mmtt -128.81 122.4 21.47 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.563 0.697 . . . . 73.31 110.886 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 138.41 37.56 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.635 2.223 . . . . 73.23 112.352 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.81 84.55 0.31 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 63.13 110.899 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.1 m -64.32 135.28 28.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 74.23 111.1 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.5 mtm . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 65.01 110.847 179.87 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.475 ' HB3' HG23 ' A' ' 126' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.79 0.328 . . . . 73.41 110.896 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -91.64 88.56 6.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 53.1 110.883 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -77.91 126.78 31.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 72.24 110.912 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -123.77 128.26 49.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.094 -0.503 . . . . 62.21 110.879 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 5.8 m -88.99 165.24 14.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 74.44 110.92 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -59.53 -19.16 46.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 53.22 110.886 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -37.01 82.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 74.13 110.887 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -104.28 -21.1 13.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 64.51 110.854 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.49 ' HB2' HD11 ' B' ' 305' ' ' LEU . 3.6 m-20 -141.57 77.22 19.63 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.618 0.723 . . . . 74.14 110.813 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -6.76 19.37 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.732 2.288 . . . . 75.32 112.328 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 10.4 t -93.79 27.45 2.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.192 -0.458 . . . . 63.04 111.152 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' B' ' 302' ' ' ASP . 48.3 mt -100.84 136.96 39.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.192 -0.458 . . . . 75.32 110.89 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.592 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.6 t -108.84 174.35 5.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 75.13 111.183 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -50.26 -35.37 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.254 -0.43 . . . . 71.13 110.847 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . 0.42 ' H ' HG23 ' B' ' 306' ' ' THR . 1.2 tm-20 -63.16 -46.88 85.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.131 -0.486 . . . . 73.22 110.935 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.592 ' HG2' HG22 ' B' ' 306' ' ' THR . 11.6 mm-40 -68.4 -47.58 66.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.137 -0.483 . . . . 72.33 110.889 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.418 HD12 ' CG ' ' A' ' 111' ' ' ASN . 44.2 mm -56.03 -45.41 80.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 75.22 111.124 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 59.0 p -76.67 -15.86 59.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 70.15 110.859 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -74.92 -17.27 60.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.499 . . . . 62.51 111.066 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.5 ptp . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 32.11 110.875 179.971 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 13.7 t . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.851 0.358 . . . . 62.35 110.808 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.1 p 67.28 131.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 73.35 110.894 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.846 HG23 ' HA3' ' A' ' 162' ' ' GLY . 2.1 p -48.59 130.88 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.131 -0.486 . . . . 63.22 111.112 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -146.72 74.65 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 64.24 110.868 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.7 mttt . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 121.582 0.706 . . . . 74.24 110.847 179.934 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.158 0 CA-C-O 120.75 0.229 . . . . 73.1 112.319 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.406 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 41.5 p-90 -102.18 -26.15 13.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.23 -0.441 . . . . 74.43 110.893 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -96.01 99.7 11.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 75.13 110.857 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.8 m-70 -75.63 -36.68 60.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 65.02 110.926 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.71 27.36 58.83 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.703 -0.761 . . . . 61.35 112.52 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.46 63.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.83 0.348 . . . . 74.41 110.973 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 15.3 mm -126.76 144.0 38.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.468 . . . . 62.22 111.13 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.466 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -93.93 171.83 8.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.21 111.173 179.906 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.466 ' H ' HG22 ' A' ' 88' ' ' THR . 6.6 ppt_? -63.32 -38.24 90.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 74.42 110.839 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -76.63 -30.84 57.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 73.44 110.991 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -70.9 -43.28 68.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.099 -0.501 . . . . 74.03 110.957 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.472 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -72.72 -37.26 67.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 74.44 111.152 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.79 -53.1 62.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 71.42 110.906 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -33.91 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 71.33 110.841 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 92' ' ' ALA . 9.8 mt -54.69 -38.23 66.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 52.33 110.925 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.662 HD21 HD23 ' A' ' 105' ' ' LEU . 3.7 mm? -100.33 43.5 1.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.22 -0.446 . . . . 73.21 110.92 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.501 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -64.32 -59.94 9.75 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.678 0.751 . . . . 74.1 110.941 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.4 Cg_endo -69.68 123.15 9.84 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.64 2.227 . . . . 61.24 112.394 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.67 116.56 4.61 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 122.667 2.245 . . . . 74.22 112.37 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -154.99 108.76 2.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.43 . . . . 61.21 110.901 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.0 OUTLIER -61.61 111.93 2.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 62.2 111.15 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.66 -6.82 6.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.731 -0.747 . . . . 64.42 112.511 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 tp -89.73 111.95 23.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.836 0.351 . . . . 71.44 110.899 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.406 ' CD2' HD13 ' A' ' 167' ' ' LEU . 23.7 p90 -124.05 167.94 13.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 74.45 110.878 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.662 HD23 HD21 ' A' ' 96' ' ' LEU . 0.9 OUTLIER -164.67 135.22 4.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.915 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.406 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 88.6 t -110.25 138.35 38.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.472 . . . . 72.11 111.074 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -150.66 154.32 37.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.096 -0.502 . . . . 74.32 110.851 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -51.85 124.39 12.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 63.54 110.92 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.9 m -63.84 113.39 3.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.226 -0.443 . . . . 73.13 110.861 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.6 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.1 m -68.9 -56.35 8.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.109 -0.496 . . . . 65.21 111.173 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.603 ' CG ' HD12 ' B' ' 310' ' ' ILE . 23.2 m-80 -68.67 -23.86 64.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 64.44 110.942 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -115.42 94.77 40.88 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.693 0.759 . . . . 74.15 111.004 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 109.94 2.43 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.659 2.24 . . . . 73.13 112.372 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.43 3.49 24.04 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.723 -0.751 . . . . 72.24 112.536 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -129.4 -175.84 3.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.819 0.342 . . . . 71.0 110.92 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -135.93 144.87 45.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 74.21 110.948 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.7 m -108.58 141.59 40.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 71.44 111.144 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.529 ' CD2' HD11 ' A' ' 163' ' ' LEU . 0.4 OUTLIER -114.79 107.98 16.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 71.13 110.891 179.989 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . 0.564 ' SG ' HG13 ' A' ' 126' ' ' VAL . 10.5 t -93.07 134.9 34.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 61.34 110.878 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.0 t -138.07 148.35 25.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 63.42 111.126 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.653 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -100.51 111.64 23.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 61.51 110.905 -179.869 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -113.86 91.49 3.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.142 -0.481 . . . . 71.12 110.856 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 66.38 31.55 8.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 74.24 110.913 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.98 -13.28 63.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.741 -0.742 . . . . 52.43 112.544 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -87.96 140.0 29.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.799 0.333 . . . . 72.15 110.887 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.564 HG13 ' SG ' ' A' ' 119' ' ' CYS . 57.7 t -98.77 108.15 21.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 75.42 111.13 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -101.67 128.52 47.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 74.44 110.909 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 -105.41 125.04 50.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 75.34 110.874 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.615 ' CE1' HD13 ' A' ' 163' ' ' LEU . 49.3 m-85 -112.71 116.72 30.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.469 . . . . 60.23 110.909 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.22 137.19 44.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.125 -0.489 . . . . 72.31 110.811 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.451 HG12 HD11 ' A' ' 140' ' ' ILE . 39.8 mt -118.17 109.59 27.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 72.33 111.093 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.85 124.19 28.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 71.5 110.94 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.482 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -113.39 98.19 6.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.24 -0.436 . . . . 71.14 110.917 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -131.51 142.6 49.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.051 -0.522 . . . . 72.31 110.862 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.98 35.97 26.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.222 -0.445 . . . . 63.31 111.107 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 61.08 30.24 19.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 63.03 110.906 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -134.82 141.09 46.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.094 -0.503 . . . . 72.3 110.917 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.532 HD21 ' HG ' ' A' ' 149' ' ' LEU . 4.9 mp -102.39 149.52 24.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.442 . . . . 74.22 110.892 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 14.0 t -166.9 137.8 3.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 63.35 110.861 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.645 HG22 HG13 ' B' ' 317' ' ' VAL . 53.2 mt -115.7 -32.16 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.51 . . . . 73.41 111.16 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.572 ' CB ' HG21 ' B' ' 317' ' ' VAL . 49.3 t0 -97.39 10.6 39.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 71.23 110.89 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 9.7 pt-20 45.96 29.89 0.82 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.157 -0.474 . . . . 71.41 110.888 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -132.51 -40.08 1.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 73.42 110.867 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.445 HG13 ' O ' ' A' ' 144' ' ' VAL . 2.7 p -116.28 104.62 16.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 73.24 111.11 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -93.41 150.75 20.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 72.31 110.952 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . 0.474 ' CD1' HD12 ' A' ' 152' ' ' LEU . 44.8 m-85 -121.08 178.2 4.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.193 -0.458 . . . . 74.22 110.896 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -100.37 -16.08 17.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 75.25 110.891 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.476 ' C ' HD13 ' A' ' 138' ' ' LEU . 1.2 t30 -164.88 172.5 12.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 64.34 110.853 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.532 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.5 OUTLIER -74.6 -27.55 60.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 70.32 110.893 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.7 -57.21 14.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 61.1 110.85 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -66.04 -36.36 83.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 63.32 110.951 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.474 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.63 -49.52 72.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.926 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.616 HG13 HD12 ' A' ' 167' ' ' LEU . 71.3 t -63.42 -38.36 81.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 75.41 111.121 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.99 -39.35 68.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 73.14 110.844 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -71.42 -44.55 64.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 74.24 110.817 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -68.26 -20.81 64.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 64.24 110.925 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 67.2 m -84.66 -30.39 24.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 53.34 111.161 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 13.2 m -79.68 -25.12 41.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.268 -0.424 . . . . 64.35 111.123 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -162.27 155.48 20.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 74.51 110.898 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . 0.455 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -51.35 -58.4 6.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 73.4 111.089 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 51.77 29.81 6.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 73.54 110.876 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 120.57 -14.7 9.92 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.735 -0.745 . . . . 62.14 112.462 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.615 HD13 ' CE1' ' A' ' 129' ' ' TYR . 4.0 mm? -88.13 136.9 32.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.915 0.388 . . . . 74.34 110.939 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . 0.424 ' SG ' HG22 ' A' ' 165' ' ' THR . 19.3 p -53.86 -26.46 24.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 53.31 110.851 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.424 HG22 ' SG ' ' A' ' 164' ' ' CYS . 10.2 t -157.58 127.55 6.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 72.0 111.151 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -54.98 140.44 37.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 75.35 110.841 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.616 HD12 HG13 ' A' ' 153' ' ' VAL . 8.1 mt -60.31 141.44 56.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.464 . . . . 71.34 110.901 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 101' ' ' THR . 24.2 mt -126.97 -51.41 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 63.24 111.081 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -131.68 124.27 19.8 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.538 0.685 . . . . 75.0 110.922 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.89 136.65 33.17 Favored 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.664 2.243 . . . . 73.52 112.296 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.73 85.0 0.31 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 61.21 110.89 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 25.2 m -64.12 133.17 29.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 73.32 111.118 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 28.4 mtp . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 60.32 110.911 179.921 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.454 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.828 0.347 . . . . 64.12 110.934 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.83 88.82 6.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 74.14 110.86 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -77.82 147.52 35.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 72.13 111.006 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.19 129.23 19.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 62.52 110.859 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . 0.6 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -93.27 160.12 14.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 73.14 110.817 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 -61.82 -17.26 55.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 75.02 110.953 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -37.13 84.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 63.34 110.909 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -97.99 -19.17 18.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 62.33 110.915 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.528 ' HB2' HD11 ' B' ' 305' ' ' LEU . 34.4 m-20 -150.98 80.08 6.74 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.608 0.718 . . . . 75.3 110.872 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 -6.58 18.94 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.652 2.234 . . . . 72.25 112.348 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.7 t -94.06 27.45 2.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 73.33 111.049 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.528 HD11 ' HB2' ' B' ' 302' ' ' ASP . 46.2 mt -100.81 136.84 40.03 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.267 -0.424 . . . . 75.11 110.959 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.594 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.8 t -105.56 171.0 7.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 73.21 111.093 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -49.57 -35.42 20.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 61.31 110.848 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -61.38 -47.78 84.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.152 -0.476 . . . . 72.42 110.903 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.594 ' HG2' HG22 ' B' ' 306' ' ' THR . 9.7 mm-40 -67.97 -52.08 39.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 73.42 110.84 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.603 HD12 ' CG ' ' A' ' 111' ' ' ASN . 40.2 mm -56.65 -53.52 40.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 72.1 111.183 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 84.1 p -57.28 -29.85 64.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 52.23 110.789 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -69.91 -10.25 57.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 72.45 111.101 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 64.04 110.854 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 24.3 p . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.883 0.373 . . . . 53.33 110.873 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.11 151.61 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 71.43 110.884 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.645 HG13 HG22 ' A' ' 140' ' ' ILE . 5.7 m -55.89 122.89 5.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.17 -0.468 . . . . 75.51 111.143 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -131.34 74.63 1.6 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 60.11 110.846 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 121.546 0.688 . . . . 74.31 110.886 179.866 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 N--CA 1.466 -0.147 0 CA-C-O 120.795 0.248 . . . . 71.34 112.382 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.474 ' CH2' HG21 ' A' ' 153' ' ' VAL . 50.1 p-90 -54.76 -26.67 35.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 73.24 110.893 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -88.0 100.65 13.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.295 -0.411 . . . . 74.13 110.888 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -75.68 -38.39 58.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.488 . . . . 72.23 110.883 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.68 18.84 40.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.799 -0.715 . . . . 73.12 112.473 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.72 81.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.775 0.322 . . . . 75.42 110.884 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.615 HG23 ' HB3' ' A' ' 91' ' ' GLN . 29.3 mm -147.1 145.16 19.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.245 -0.434 . . . . 74.42 111.145 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -97.82 177.29 5.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 65.14 111.132 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -38.86 89.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 61.43 110.905 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -37.68 88.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.246 -0.434 . . . . 72.54 110.973 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.615 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -76.35 -37.06 57.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.077 -0.511 . . . . 70.22 110.966 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.37 -33.79 65.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 71.13 111.132 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -67.74 -53.09 30.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 73.0 110.923 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.16 -39.26 94.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 73.44 110.853 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.504 HD22 ' HE2' ' A' ' 171' ' ' LYS . 15.1 mt -58.97 -37.57 77.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 72.12 110.942 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.649 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -100.88 43.07 1.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.442 . . . . 75.42 110.902 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.496 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -70.01 -59.92 3.98 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.668 0.747 . . . . 74.23 110.924 -179.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.0 Cg_endo -69.74 124.05 10.71 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.771 2.314 . . . . 74.11 112.309 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 117.32 5.01 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.648 2.232 . . . . 74.42 112.407 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -155.09 102.6 2.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 62.51 110.884 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.668 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.2 OUTLIER -56.03 111.51 0.96 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 71.34 111.142 -179.926 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 131.28 -10.5 5.59 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.755 -0.736 . . . . 60.52 112.47 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -86.71 111.64 20.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.823 0.344 . . . . 63.15 110.933 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.418 ' HB2' HD11 ' A' ' 118' ' ' LEU . 21.0 p90 -124.2 162.38 23.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 70.45 110.888 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.644 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -159.11 135.76 9.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 75.1 110.931 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 93.1 t -109.9 134.71 51.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.221 -0.445 . . . . 54.01 111.078 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 7.5 ptt85 -148.27 141.67 25.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.451 . . . . 74.14 110.941 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -51.29 128.65 22.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 52.33 110.906 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.23 116.87 3.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 74.31 110.861 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.511 HG21 ' HG2' ' B' ' 300' ' ' GLU . 9.8 m -70.23 -26.28 63.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 52.42 111.121 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -106.68 -0.91 23.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.2 -0.455 . . . . 71.34 110.946 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.415 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 0.6 OUTLIER -139.95 90.41 10.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.641 0.734 . . . . 70.31 110.969 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 54.2 Cg_endo -69.75 118.34 5.62 Favored 'Trans proline' 0 C--N 1.34 0.131 0 C-N-CA 122.648 2.232 . . . . 74.2 112.345 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 114.19 -14.68 21.03 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.777 -0.725 . . . . 65.21 112.533 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -120.14 158.84 26.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.783 0.325 . . . . 74.31 110.911 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -113.86 149.32 35.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 72.34 110.886 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.5 m -125.48 124.51 41.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 51.22 111.125 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.523 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.4 OUTLIER -96.38 134.39 39.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 70.11 110.957 179.924 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 48.8 t -116.94 127.06 53.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.455 . . . . 53.52 110.934 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.523 ' CG2' HD21 ' A' ' 118' ' ' LEU . 14.7 t -123.68 152.82 29.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.46 . . . . 70.42 111.097 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.649 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -104.39 112.13 25.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 52.42 110.883 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.76 95.7 5.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 60.54 110.915 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 67.68 28.55 7.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.465 . . . . 75.44 110.938 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.74 -14.39 63.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.746 -0.74 . . . . 45.14 112.51 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 142.45 27.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.37 . . . . 72.12 110.897 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.554 ' O ' HD13 ' B' ' 294' ' ' LEU . 12.1 m -100.57 114.28 38.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.476 . . . . 72.54 111.185 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -104.69 123.79 48.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 72.02 110.855 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -100.52 129.17 46.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.484 . . . . 51.23 110.873 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.425 ' HB3' HD13 ' A' ' 140' ' ' ILE . 62.3 m-85 -117.94 104.01 10.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.186 -0.461 . . . . 64.32 110.901 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.552 ' O ' HG23 ' A' ' 140' ' ' ILE . 0.1 OUTLIER -58.02 140.18 52.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 71.23 110.905 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.411 HG12 HD11 ' A' ' 140' ' ' ILE . 44.2 mt -124.97 109.39 22.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 71.0 111.083 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.65 131.7 36.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 70.45 110.832 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.451 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -117.62 102.4 9.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.24 -0.436 . . . . 73.54 110.898 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -138.76 142.59 38.8 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 75.31 110.833 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 59.06 35.96 24.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 32.43 111.117 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 59.88 31.14 20.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.431 . . . . 62.25 110.835 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -137.8 143.16 40.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.468 . . . . 74.43 110.954 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.451 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 3.7 mp -105.57 152.18 23.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 64.1 110.946 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 43.9 t -169.91 141.65 2.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 61.32 110.837 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.552 HG23 ' O ' ' A' ' 130' ' ' ARG . 44.5 mt -113.31 -36.39 2.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 74.33 111.175 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.804 ' HB3' HG21 ' B' ' 317' ' ' VAL . 9.0 p30 -87.9 -1.57 58.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 62.21 110.886 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 61.07 17.38 7.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 74.04 110.812 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -126.19 -32.29 2.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 74.11 110.902 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -114.03 104.85 17.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.491 . . . . 74.14 111.068 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -97.63 144.35 27.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 62.24 110.886 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -117.72 171.58 7.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 73.31 110.892 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.23 -15.45 31.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 72.1 110.914 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -175.27 158.65 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 75.3 110.919 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.433 ' N ' HD13 ' A' ' 138' ' ' LEU . 1.0 OUTLIER -51.43 -36.73 45.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.467 . . . . 74.02 110.897 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.1 ttt -51.84 -50.17 61.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 72.32 110.956 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -67.89 -41.6 82.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 73.42 110.925 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -47.38 77.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 71.15 110.918 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.474 HG21 ' CH2' ' A' ' 82' ' ' TRP . 89.7 t -63.77 -38.03 81.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 64.21 111.074 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -57.86 -38.33 75.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.137 -0.483 . . . . 74.2 110.852 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.81 -48.16 48.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 64.45 110.858 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.45 ' CD1' HD13 ' A' ' 163' ' ' LEU . 47.2 m-85 -67.02 -20.12 65.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 64.41 110.95 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 77.9 m -84.91 -30.07 24.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 64.41 111.167 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 72.3 m -79.69 -25.01 41.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.147 -0.479 . . . . 65.4 111.193 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.68 167.35 25.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 71.44 110.836 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.11 -57.88 7.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 54.11 111.109 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.09 17.45 9.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 55.24 110.882 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.55 15.92 9.89 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.756 -0.735 . . . . 63.3 112.451 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.45 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.8 mp -112.19 137.64 50.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.894 0.378 . . . . 63.12 110.935 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 23.7 t -51.51 -30.13 19.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.178 -0.465 . . . . 73.01 110.89 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.604 ' HB ' HG22 ' A' ' 101' ' ' THR . 2.6 t -151.45 120.47 6.68 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.176 -0.466 . . . . 73.24 111.101 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.09 151.81 4.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 75.24 110.897 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.439 ' CD1' HG13 ' A' ' 153' ' ' VAL . 6.4 mt -67.56 133.85 50.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.184 -0.462 . . . . 72.42 110.878 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.668 HD12 ' O ' ' A' ' 101' ' ' THR . 24.7 mt -127.03 -51.32 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 73.4 111.129 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -126.66 120.29 23.04 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.602 0.715 . . . . 75.13 110.911 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 135.08 29.52 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.677 2.251 . . . . 75.35 112.273 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . 0.504 ' HE2' HD22 ' A' ' 95' ' ' LEU . 0.3 OUTLIER -69.02 84.75 0.34 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 75.25 110.879 179.897 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 19.1 t -64.38 140.58 19.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 74.5 111.143 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 3.8 ptt? . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 65.44 110.882 179.968 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.554 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.816 0.341 . . . . 71.2 110.883 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.21 88.14 2.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.207 -0.451 . . . . 74.24 110.853 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -85.26 149.16 25.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.501 . . . . 65.25 110.888 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.32 128.69 16.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.14 -0.482 . . . . 74.33 110.93 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.39 158.71 18.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 73.2 110.862 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 28.2 mtt180 -58.12 -20.27 39.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 64.23 110.895 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . 0.511 ' HG2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -61.94 -36.5 81.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 75.32 110.884 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -99.32 -24.69 14.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.463 . . . . 73.01 110.926 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -143.69 79.16 13.81 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.663 0.744 . . . . 73.05 110.828 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 -5.69 16.78 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.661 2.241 . . . . 72.34 112.394 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.7 t -92.48 27.44 2.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 71.31 111.205 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 22.8 mt -102.9 136.71 42.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.462 . . . . 42.53 110.925 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.637 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.7 t -105.65 173.49 6.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 71.15 111.172 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -49.9 -37.4 31.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 71.34 110.84 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 34.6 tp10 -60.92 -52.14 66.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 65.51 110.932 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.637 ' HG2' HG22 ' B' ' 306' ' ' THR . 9.2 mm-40 -65.11 -51.94 58.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.07 -0.513 . . . . 74.14 110.916 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 45.5 mm -55.88 -54.35 27.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 63.4 111.122 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 50.6 m -62.85 -18.48 62.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 41.44 110.876 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -80.16 1.18 29.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 74.32 111.091 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 4.1 mtm . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.441 . . . . 73.21 110.957 179.934 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 38.1 t . . . . . 0 CA--C 1.527 0.072 0 CA-C-O 120.851 0.358 . . . . 61.22 110.828 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 65.21 149.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 72.1 110.841 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.804 HG21 ' HB3' ' A' ' 141' ' ' ASP . 13.5 m -62.17 125.99 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 72.05 111.172 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -140.39 82.89 1.88 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 54.53 110.879 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.575 0.702 . . . . 42.12 110.912 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.465 -0.191 0 CA-C-O 120.815 0.256 . . . . 72.53 112.381 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.442 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 41.1 p-90 -102.28 -30.39 11.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.23 110.908 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -84.93 101.1 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 74.33 110.819 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.84 -37.5 58.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 75.11 110.848 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.55 18.62 38.28 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.774 -0.727 . . . . 54.13 112.52 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.92 80.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.812 0.339 . . . . 72.01 110.93 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 16.7 mm -141.42 144.29 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 75.21 111.085 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 m -98.7 160.42 14.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.15 -0.477 . . . . 63.14 111.168 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.83 -41.05 61.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.243 -0.435 . . . . 73.21 110.827 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -69.67 -36.0 75.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.257 -0.429 . . . . 70.33 110.902 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -70.28 -41.92 72.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 70.14 110.824 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.93 -33.85 59.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 45.24 111.1 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -58.81 -52.29 66.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 73.43 110.838 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.68 -37.36 79.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 64.05 110.866 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.3 mt -55.04 -38.29 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 63.41 110.94 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.67 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -100.32 43.61 1.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.447 . . . . 72.12 110.867 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.48 -60.13 5.13 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.68 0.752 . . . . 73.32 110.929 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.0 Cg_endo -69.76 123.43 10.09 Favored 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.696 2.264 . . . . 74.1 112.311 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.85 117.89 5.36 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.693 2.262 . . . . 72.03 112.308 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.82 104.95 2.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 75.21 110.864 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 168' ' ' ILE . 5.0 p -57.99 111.95 1.34 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.095 -0.502 . . . . 51.43 111.132 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.52 -6.24 6.25 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.744 -0.741 . . . . 41.44 112.55 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.73 112.62 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 73.25 110.913 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -123.96 166.55 15.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 73.53 110.915 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.598 HD23 HD21 ' A' ' 96' ' ' LEU . 0.9 OUTLIER -162.0 136.53 6.9 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 63.33 110.903 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.442 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 86.1 t -110.05 140.35 29.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 72.54 111.101 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -153.63 146.58 24.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 63.12 110.866 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -50.79 123.92 10.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.16 -0.473 . . . . 75.25 110.899 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.4 m -59.67 113.48 2.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 74.54 110.848 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.61 HG21 ' HB2' ' B' ' 298' ' ' SER . 2.2 m -68.55 -55.87 10.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 70.44 111.143 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -63.67 -29.26 70.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 61.41 110.934 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.429 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 1.2 m-85 -119.38 97.69 50.26 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.691 0.758 . . . . 72.33 110.884 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.6 Cg_endo -69.72 117.68 5.22 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.677 2.252 . . . . 73.34 112.347 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.61 -2.78 24.75 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.74 -0.743 . . . . 53.25 112.482 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -122.75 -176.33 3.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.866 0.365 . . . . 54.25 110.808 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -135.24 142.53 46.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 73.43 110.869 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.5 m -109.64 137.79 46.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.127 -0.488 . . . . 70.03 111.166 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.84 114.68 28.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 63.2 110.932 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.2 t -100.82 129.95 46.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 74.34 110.844 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.9 t -131.29 150.43 34.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 73.12 111.101 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.67 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -102.92 111.44 23.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.466 . . . . 74.33 110.828 -179.835 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.02 92.38 3.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.088 -0.506 . . . . 61.33 110.876 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 66.61 30.8 8.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 74.1 110.926 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 98.25 -13.64 62.99 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.727 -0.749 . . . . 73.3 112.535 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.78 140.02 29.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.855 0.359 . . . . 64.22 110.939 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.45 ' O ' HD22 ' B' ' 294' ' ' LEU . 6.7 m -101.3 105.53 17.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.266 -0.424 . . . . 63.41 111.082 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -97.11 129.67 44.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 74.34 110.855 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -106.66 124.3 49.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 73.11 110.845 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -111.96 102.98 11.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.261 -0.427 . . . . 65.54 110.95 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -59.68 140.09 56.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 71.2 110.859 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.501 HG12 HD11 ' A' ' 140' ' ' ILE . 42.2 mt -120.45 109.01 24.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.468 . . . . 63.13 111.147 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.38 130.45 40.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 75.11 110.884 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -116.74 113.51 22.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.232 -0.44 . . . . 73.24 110.886 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -146.26 136.89 24.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 74.4 110.829 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.15 35.85 23.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 75.1 111.043 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.32 30.53 15.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.269 -0.423 . . . . 62.31 110.829 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -130.6 138.28 50.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 75.51 110.933 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.57 HD21 ' HG ' ' A' ' 149' ' ' LEU . 3.7 mp -101.16 150.47 22.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 74.43 110.915 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -168.38 134.97 1.96 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 63.32 110.827 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.501 HD11 HG12 ' A' ' 131' ' ' ILE . 51.8 mt -113.32 -40.66 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 72.22 111.107 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.771 ' HB3' HG21 ' B' ' 317' ' ' VAL . 15.9 p30 -84.49 -5.64 59.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 64.21 110.919 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 61.57 16.29 7.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.11 110.853 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -125.36 -8.15 6.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 64.23 110.897 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 6.0 t -144.35 104.5 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 63.42 111.102 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -94.76 146.77 23.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.148 -0.478 . . . . 72.33 110.902 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -117.33 176.15 5.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 63.44 110.911 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -100.44 -14.56 18.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 73.12 110.861 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . 0.421 ' C ' HD13 ' A' ' 138' ' ' LEU . 1.9 t30 -167.05 171.87 10.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 74.34 110.918 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.57 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.6 OUTLIER -74.49 -22.72 58.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.15 -0.477 . . . . 53.34 110.907 179.95 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.2 ttt -61.58 -56.76 16.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 53.3 110.912 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -67.18 -36.3 81.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 70.33 110.943 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.26 -53.15 59.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 61.12 110.931 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.451 HG13 ' CD1' ' A' ' 167' ' ' LEU . 65.3 t -62.2 -36.74 76.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 53.34 111.14 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -54.78 -39.76 68.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.069 -0.514 . . . . 64.44 110.933 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -71.75 -49.01 42.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.13 -0.486 . . . . 73.24 110.838 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.408 ' CD1' HD13 ' A' ' 163' ' ' LEU . 38.3 m-85 -62.92 -23.67 67.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.233 -0.44 . . . . 71.11 110.939 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.553 ' OG1' HD12 ' A' ' 167' ' ' LEU . 94.1 m -83.96 -29.47 27.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.082 -0.508 . . . . 63.33 111.155 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 42.3 m -77.65 -23.52 49.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 71.11 111.164 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -165.24 160.17 18.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.205 -0.452 . . . . 71.44 110.857 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.91 -58.12 6.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 62.24 111.157 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 21.5 t70 55.87 25.11 8.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 71.22 110.834 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 118.73 -10.86 12.29 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.792 -0.718 . . . . 44.43 112.441 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.408 HD13 ' CD1' ' A' ' 156' ' ' TYR . 10.8 mp -87.21 138.66 31.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.87 0.367 . . . . 63.0 110.85 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . 0.465 ' SG ' HG22 ' A' ' 165' ' ' THR . 18.4 p -54.6 -26.31 31.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 71.13 110.936 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.465 HG22 ' SG ' ' A' ' 164' ' ' CYS . 9.2 t -157.54 124.98 5.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.133 -0.485 . . . . 61.12 111.128 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -52.66 147.9 7.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 71.3 110.815 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.553 HD12 ' OG1' ' A' ' 157' ' ' THR . 7.5 mt -65.93 138.83 58.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.1 -0.5 . . . . 74.34 110.915 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 101' ' ' THR . 24.9 mt -127.16 -51.29 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 63.45 111.094 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -129.93 122.25 20.3 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.531 0.681 . . . . 74.23 110.873 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.86 138.95 38.69 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.689 2.259 . . . . 52.53 112.287 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 84.13 0.42 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 64.3 110.85 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 15.2 m -64.37 130.75 29.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 53.43 111.12 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.31 110.845 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.45 HD22 ' O ' ' A' ' 126' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.764 0.316 . . . . 73.41 110.876 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.4 m -100.47 88.74 3.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 72.13 110.894 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -83.53 147.27 27.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 73.32 110.97 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.1 128.82 21.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.114 -0.493 . . . . 72.32 110.937 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . 0.61 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -87.87 156.09 19.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 73.55 110.893 -179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -60.85 -18.0 53.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.853 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.2 -39.05 86.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 74.43 110.848 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -92.5 -20.49 20.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.878 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.487 ' HB2' HD11 ' B' ' 305' ' ' LEU . 30.2 m-20 -148.84 81.36 7.71 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.674 0.749 . . . . 74.45 110.902 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -6.84 19.53 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.711 2.274 . . . . 74.44 112.374 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.3 t -94.13 27.3 2.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.205 -0.452 . . . . 70.42 111.097 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.632 HD13 ' OE2' ' B' ' 309' ' ' GLU . 62.2 mt -100.4 136.7 39.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.264 -0.425 . . . . 74.01 110.914 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.461 HG23 ' H ' ' B' ' 309' ' ' GLU . 7.2 t -93.82 152.99 18.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.454 . . . . 74.52 111.142 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -49.1 -31.83 8.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 65.23 110.9 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.77 -54.97 40.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 60.52 110.881 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.632 ' OE2' HD13 ' B' ' 305' ' ' LEU . 0.3 OUTLIER -57.15 -32.41 66.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 70.12 110.935 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.635 ' HA ' ' HE2' ' B' ' 313' ' ' MET . 27.0 mm -63.31 -53.2 48.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 65.34 111.099 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.33 -21.26 63.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 70.25 110.868 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -76.88 -3.13 37.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.499 . . . . 62.04 111.139 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . 0.635 ' HE2' ' HA ' ' B' ' 310' ' ' ILE . 2.6 mtm . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 72.35 110.822 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 43.9 t . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.837 0.351 . . . . 31.32 110.812 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 65.94 145.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 71.41 110.86 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.771 HG21 ' HB3' ' A' ' 141' ' ' ASP . 6.7 m -56.63 116.29 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 61.24 111.139 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -125.21 74.89 1.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 75.35 110.88 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 13.3 mtmt . . . . . 0 C--N 1.328 -0.348 0 CA-C-O 121.652 0.739 . . . . 74.51 110.919 179.906 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.159 0 CA-C-O 120.784 0.243 . . . . 75.25 112.323 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.42 ' CH2' HG21 ' A' ' 153' ' ' VAL . 34.2 p-90 -101.51 -30.9 11.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 73.24 110.908 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -87.32 99.48 12.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 75.01 110.851 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -75.71 -33.64 60.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 74.13 110.909 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.95 19.59 37.93 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.738 -0.744 . . . . 72.32 112.449 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.08 82.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.77 0.319 . . . . 75.51 110.919 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.625 HG23 ' HB3' ' A' ' 91' ' ' GLN . 29.5 mm -146.8 145.04 19.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 72.23 111.158 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.2 p -101.14 177.34 4.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 62.04 111.096 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -41.08 97.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 63.3 110.82 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -62.91 -38.26 90.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 72.54 110.938 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.625 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -75.73 -36.23 60.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.105 -0.498 . . . . 63.03 110.962 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.41 -33.83 67.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 73.04 111.101 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -68.69 -53.14 24.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 63.21 110.878 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.17 -40.03 96.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 64.45 110.856 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 91' ' ' GLN . 14.9 mt -58.63 -38.2 77.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 73.31 110.911 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.645 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -101.42 43.36 1.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 75.42 110.852 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.29 -60.13 4.39 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.68 0.752 . . . . 72.35 110.902 179.924 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.4 Cg_endo -69.72 124.08 10.75 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.615 2.21 . . . . 70.33 112.445 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 116.92 4.78 Favored 'Trans proline' 0 C--O 1.23 0.124 0 C-N-CA 122.704 2.269 . . . . 54.23 112.325 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -154.79 110.58 3.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 62.13 110.863 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.638 ' O ' HD12 ' A' ' 168' ' ' ILE . 1.1 p -62.71 111.8 2.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 63.31 111.114 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.76 -7.07 6.17 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.74 -0.743 . . . . 72.12 112.443 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.453 HD21 ' HE3' ' A' ' 171' ' ' LYS . 3.0 tp -89.51 111.59 22.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 73.54 110.969 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.469 ' HB3' HD22 ' A' ' 167' ' ' LEU . 19.6 p90 -123.31 167.7 13.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.213 -0.449 . . . . 74.42 110.885 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.586 HD23 HD21 ' A' ' 96' ' ' LEU . 1.0 OUTLIER -162.45 134.02 5.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 45.3 110.873 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.2 t -110.03 140.04 30.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 74.51 111.067 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.5 151.65 29.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 74.35 110.884 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -51.38 124.24 11.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 70.1 110.904 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.6 m -59.17 112.05 1.57 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 53.1 110.86 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.601 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.3 m -68.77 -56.46 7.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 61.13 111.126 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.43 ' CG ' HD12 ' B' ' 310' ' ' ILE . 30.8 m-80 -67.26 -24.99 65.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 62.1 110.915 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -116.42 95.43 45.51 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.69 0.757 . . . . 75.45 110.896 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 110.52 2.58 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.66 2.24 . . . . 63.24 112.353 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.7 6.31 21.41 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.707 -0.759 . . . . 42.14 112.461 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -132.44 -177.81 4.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.797 0.332 . . . . 71.55 110.841 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -129.01 155.83 44.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 70.01 110.88 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.9 m -125.84 139.94 53.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.07 -0.514 . . . . 75.14 111.123 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.71 115.01 26.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.197 -0.456 . . . . 72.31 110.931 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.6 t -100.83 126.97 47.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.42 110.889 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.4 t -127.81 153.28 36.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 74.41 111.127 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.645 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -104.24 111.76 24.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.461 . . . . 72.03 110.823 -179.787 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.47 92.37 3.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 44.41 110.844 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 66.95 31.25 7.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 65.02 110.89 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.71 -14.48 62.99 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.739 -0.743 . . . . 64.31 112.511 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -87.56 143.38 27.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.796 0.331 . . . . 61.12 110.916 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.587 ' O ' HD13 ' B' ' 294' ' ' LEU . 9.9 m -103.8 112.97 39.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 71.41 111.12 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.5 pm0 -105.54 126.56 52.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 70.41 110.913 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -103.33 126.46 50.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.171 -0.468 . . . . 73.32 110.854 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.433 ' HB3' HD13 ' A' ' 140' ' ' ILE . 32.0 m-85 -110.49 116.17 30.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 71.4 110.87 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.645 ' O ' HG23 ' A' ' 140' ' ' ILE . 0.0 OUTLIER -70.04 136.92 50.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.102 -0.499 . . . . 75.23 110.885 179.99 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.426 HG12 HD11 ' A' ' 140' ' ' ILE . 81.2 mt -118.61 109.28 26.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 52.11 111.101 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.11 130.41 39.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 73.42 110.853 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -114.09 116.67 29.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.878 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -150.35 136.07 18.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 72.32 110.852 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.11 35.93 23.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.198 -0.456 . . . . 60.13 111.108 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.71 29.98 14.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 63.25 110.889 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -129.29 142.24 50.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 72.13 110.887 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.589 HD21 ' HG ' ' A' ' 149' ' ' LEU . 2.1 mp -106.09 148.62 27.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 71.53 110.966 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.2 t -166.95 131.29 1.97 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.226 -0.443 . . . . 74.53 110.899 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.645 HG23 ' O ' ' A' ' 130' ' ' ARG . 41.0 mt -107.48 -32.25 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 64.41 111.13 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.471 ' HA ' HG21 ' B' ' 317' ' ' VAL . 35.6 t0 -86.59 -1.17 57.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 71.3 110.845 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 60.64 17.85 7.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 60.02 110.849 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -132.46 -38.43 1.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 70.24 110.961 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.0 t -104.49 104.55 17.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.075 -0.511 . . . . 72.01 111.109 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -98.78 146.02 26.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.18 -0.463 . . . . 75.2 110.95 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -116.71 178.25 4.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 73.15 110.895 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.5 -15.87 17.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.173 -0.467 . . . . 74.2 110.905 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -165.81 171.89 12.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 74.21 110.869 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.589 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.6 OUTLIER -75.05 -22.8 58.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 73.34 110.909 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -56.76 13.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 74.25 110.875 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -65.86 -35.2 79.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 53.54 110.913 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.35 -52.69 62.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 61.5 110.975 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.488 HG13 ' CD1' ' A' ' 167' ' ' LEU . 75.0 t -62.67 -36.61 76.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 73.13 111.126 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -55.02 -39.29 68.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.117 -0.492 . . . . 74.34 110.887 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.97 -45.99 58.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 74.34 110.887 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.424 ' CD1' HD13 ' A' ' 163' ' ' LEU . 36.2 m-85 -65.63 -23.68 66.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 64.21 110.99 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 87.3 m -84.14 -28.94 27.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 74.41 111.131 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 29.1 m -77.67 -26.21 50.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 61.13 111.163 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -165.03 162.85 20.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 71.34 110.892 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.99 -58.4 6.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 52.21 111.126 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 32.0 t70 57.93 21.69 7.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 72.41 110.876 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.27 7.33 21.11 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.803 -0.713 . . . . 44.44 112.518 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.424 HD13 ' CD1' ' A' ' 156' ' ' TYR . 7.8 mp -100.66 138.92 37.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.787 0.327 . . . . 73.41 110.959 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 36.1 t -51.35 -30.8 19.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 41.31 110.889 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 9.5 t -158.47 126.17 5.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 74.24 111.184 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -51.69 152.41 2.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 71.43 110.823 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.488 ' CD1' HG13 ' A' ' 153' ' ' VAL . 9.9 mt -74.33 139.04 43.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 63.02 110.847 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.638 HD12 ' O ' ' A' ' 101' ' ' THR . 26.1 mt -127.14 -51.18 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 65.11 111.124 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . 0.408 ' O ' HD12 ' A' ' 103' ' ' LEU . 4.1 mtmt -130.19 119.44 18.69 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.596 0.712 . . . . 73.43 110.831 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 140.76 43.39 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.716 2.277 . . . . 72.32 112.287 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . 0.453 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -69.65 83.76 0.44 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.163 -0.472 . . . . 64.01 110.899 179.895 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 30.2 m -64.45 126.28 22.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 74.31 111.154 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.4 mtm . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 61.21 110.894 179.949 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.587 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.832 0.348 . . . . 63.15 110.895 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.74 91.07 8.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 72.3 110.865 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -79.85 149.59 30.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 73.43 110.907 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -144.34 129.18 18.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.067 -0.515 . . . . 72.33 110.944 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . 0.601 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -94.89 158.37 15.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 74.51 110.905 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -62.75 -16.64 58.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.181 -0.463 . . . . 74.2 110.871 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -39.28 90.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 71.25 110.852 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -90.61 -25.38 20.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 64.13 110.812 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.494 ' HB2' HD11 ' B' ' 305' ' ' LEU . 12.5 m-20 -147.03 84.97 7.14 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.627 0.727 . . . . 72.54 110.882 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.76 -6.6 19.0 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.699 2.266 . . . . 75.15 112.367 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.2 t -94.39 27.36 2.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 74.22 111.149 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.643 HD13 ' OE2' ' B' ' 309' ' ' GLU . 57.3 mt -101.11 136.83 40.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 72.22 110.879 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.461 HG23 ' H ' ' B' ' 309' ' ' GLU . 10.1 t -92.02 152.89 19.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 73.25 111.116 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -49.89 -31.2 11.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 75.54 110.895 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -54.07 50.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 74.41 110.865 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.643 ' OE2' HD13 ' B' ' 305' ' ' LEU . 0.3 OUTLIER -58.92 -32.45 69.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 64.11 110.91 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.43 HD12 ' CG ' ' A' ' 111' ' ' ASN . 30.5 mm -62.08 -53.67 44.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.152 -0.476 . . . . 53.13 111.076 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 1.1 p -56.9 -30.78 64.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 71.43 110.926 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -64.39 -15.14 59.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.513 . . . . 60.32 111.108 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . 0.408 ' HE2' ' HA ' ' B' ' 310' ' ' ILE . 1.6 mtm . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 74.2 110.925 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 120.843 0.354 . . . . 63.12 110.829 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.3 156.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 72.34 110.837 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.471 HG21 ' HA ' ' A' ' 141' ' ' ASP . 5.7 m -51.41 130.09 11.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.06 -0.518 . . . . 60.22 111.138 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -145.76 75.01 1.41 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.192 -0.458 . . . . 72.43 110.891 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-O 121.593 0.711 . . . . 73.42 110.879 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo . . . . . 0 N--CA 1.466 -0.127 0 CA-C-O 120.79 0.246 . . . . 53.23 112.406 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.466 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 47.6 p-90 -54.83 -25.75 30.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 71.34 110.919 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -90.66 99.26 12.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 74.14 110.899 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -75.96 -41.99 49.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.106 -0.497 . . . . 74.33 110.906 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.54 25.39 55.17 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.731 -0.747 . . . . 72.03 112.541 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.4 65.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 63.21 110.875 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.617 HG23 ' HB3' ' A' ' 91' ' ' GLN . 26.8 mm -136.06 145.25 31.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 73.1 111.084 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.9 p -97.48 177.09 5.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 73.24 111.15 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -65.98 -39.46 90.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 73.15 110.822 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.92 -37.63 88.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.261 -0.427 . . . . 71.32 110.897 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.617 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -76.01 -37.83 58.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.506 . . . . 73.53 110.904 -179.865 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.57 -33.98 67.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 65.2 111.118 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -67.14 -53.14 33.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 62.31 110.886 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -40.06 94.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 72.1 110.896 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.6 mt -56.41 -38.85 72.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 73.22 110.95 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.675 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.5 mm? -99.48 43.26 1.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 63.14 110.902 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.11 -60.04 4.62 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.717 0.77 . . . . 71.31 110.891 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.5 Cg_endo -69.79 123.99 10.63 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.728 2.286 . . . . 64.35 112.315 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.65 117.69 5.23 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.706 2.27 . . . . 73.41 112.38 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -155.12 103.67 2.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 71.13 110.841 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.657 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -57.33 111.83 1.21 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 72.53 111.116 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.34 -8.92 5.93 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.761 -0.733 . . . . 32.13 112.523 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.6 tp -88.07 111.89 22.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.891 0.377 . . . . 71.21 110.875 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.453 ' HB2' HD11 ' A' ' 118' ' ' LEU . 25.7 p90 -123.54 165.31 17.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 74.43 110.888 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.624 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -161.58 137.34 7.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.478 . . . . 61.22 110.883 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.466 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 91.1 t -109.52 129.91 63.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.221 -0.445 . . . . 51.41 111.15 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.91 137.93 29.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 71.04 110.946 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.4 126.96 18.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.45 . . . . 73.15 110.935 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.0 m -55.57 114.01 1.68 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.794 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 m -70.07 -49.16 53.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.135 -0.484 . . . . 64.34 111.098 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.405 ' ND2' HD12 ' B' ' 310' ' ' ILE . 16.7 p30 -80.16 -3.17 47.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 71.51 110.932 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -139.48 88.6 12.52 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.615 0.721 . . . . 72.13 110.897 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 122.29 8.98 Favored 'Trans proline' 0 C--N 1.34 0.117 0 C-N-CA 122.679 2.252 . . . . 70.22 112.341 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.87 -8.21 23.62 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.714 -0.755 . . . . 54.53 112.567 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -127.94 -179.64 5.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.759 0.314 . . . . 65.3 110.9 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -130.86 164.33 25.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 73.24 110.94 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 97.3 m -143.87 128.16 17.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 72.15 111.138 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.453 HD11 ' HB2' ' A' ' 104' ' ' PHE . 0.3 OUTLIER -97.31 132.75 42.74 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.272 -0.422 . . . . 42.44 110.917 179.909 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 5.8 m -113.02 126.54 55.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.166 -0.47 . . . . 74.44 110.908 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.3 t -126.61 152.37 34.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 53.33 111.116 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.675 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -104.66 111.9 24.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 60.21 110.87 -179.877 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -115.26 93.04 4.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 25.05 110.911 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 66.68 31.03 7.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 73.2 110.887 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.31 -12.87 65.0 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.79 -0.719 . . . . 44.1 112.491 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.18 139.91 30.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.805 0.336 . . . . 73.52 110.906 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.528 ' O ' HD13 ' B' ' 294' ' ' LEU . 92.6 t -99.93 111.21 28.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.24 -0.436 . . . . 65.24 111.21 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -102.89 129.9 49.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 74.1 110.866 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -105.36 127.28 52.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 74.5 110.824 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.63 ' CZ ' HD13 ' A' ' 163' ' ' LEU . 44.7 m-85 -113.71 111.11 21.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.29 -0.414 . . . . 61.02 110.93 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -63.32 137.16 58.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.066 -0.516 . . . . 65.31 110.841 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.468 ' CG2' HD23 ' A' ' 138' ' ' LEU . 54.3 mt -119.66 109.43 26.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.139 -0.482 . . . . 73.42 111.132 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -84.63 121.4 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.34 110.954 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.476 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -110.5 98.11 7.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.327 -0.397 . . . . 71.05 111.013 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -132.03 142.65 49.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.463 . . . . 62.1 110.844 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.55 35.95 26.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 40.25 111.165 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 12.5 t 61.31 30.12 18.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 65.42 110.812 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -135.57 143.56 45.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.466 . . . . 75.24 110.942 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.476 HD21 ' CE2' ' A' ' 133' ' ' TYR . 4.0 mp -106.37 149.8 26.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 63.32 110.966 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.27 140.82 5.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 60.0 110.836 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.479 HG22 HG13 ' B' ' 317' ' ' VAL . 49.8 mt -115.61 -34.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 72.21 111.148 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.716 ' CB ' HG21 ' B' ' 317' ' ' VAL . 31.6 p-10 -96.65 11.53 35.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 71.24 110.875 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 6.6 pt-20 45.76 30.73 0.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 74.1 110.898 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -131.88 -39.96 1.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.112 -0.494 . . . . 70.42 110.906 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 144' ' ' VAL . 2.6 p -116.6 104.51 16.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 61.35 111.087 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -93.0 148.91 21.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 75.21 110.957 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -119.4 177.71 4.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 54.23 110.821 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -100.52 -15.52 17.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 53.34 110.919 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -165.81 172.12 12.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 64.31 110.883 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -22.57 59.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 63.11 110.912 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.2 ttp -62.73 -57.0 12.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.471 . . . . 75.51 110.84 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -66.17 -35.56 80.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.948 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.45 -49.9 71.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 74.45 110.923 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.722 HG13 HD12 ' A' ' 167' ' ' LEU . 73.8 t -64.01 -38.19 81.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.183 -0.462 . . . . 54.05 111.192 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.84 -38.17 67.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.11 -0.495 . . . . 62.14 110.926 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.24 -46.1 57.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 71.53 110.888 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.414 ' CD1' HD23 ' A' ' 163' ' ' LEU . 35.6 m-85 -70.86 -11.28 60.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.217 -0.447 . . . . 73.33 110.938 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.4 m -92.2 -32.43 15.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.105 -0.498 . . . . 62.44 111.128 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 5.7 t -80.35 -25.64 39.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.304 -0.407 . . . . 71.51 111.078 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -157.53 158.06 34.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.304 -0.407 . . . . 75.34 110.853 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.89 -56.48 12.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 72.43 111.103 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 58.12 22.63 9.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 74.41 110.846 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.28 11.17 18.65 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.752 . . . . 62.44 112.466 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.63 HD13 ' CZ ' ' A' ' 129' ' ' TYR . 3.1 mm? -105.62 134.5 48.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.928 0.394 . . . . 72.23 110.943 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 23.5 t -51.71 -29.71 19.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.148 -0.478 . . . . 63.5 110.849 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.4 ' HB ' HG22 ' A' ' 101' ' ' THR . 3.0 t -153.03 120.44 5.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 70.5 111.116 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -53.54 143.0 20.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 73.5 110.913 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.722 HD12 HG13 ' A' ' 153' ' ' VAL . 7.7 mt -61.56 135.58 57.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 44.42 110.888 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.657 HD12 ' O ' ' A' ' 101' ' ' THR . 27.0 mt -127.19 -51.41 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 64.43 111.117 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.4 120.04 22.01 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.605 0.717 . . . . 73.44 110.841 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 133.83 26.48 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.699 2.266 . . . . 73.42 112.302 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.94 83.67 0.49 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 61.4 110.883 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.8 m -64.55 144.97 14.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 61.32 111.173 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 7.8 ptm . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 71.34 110.886 179.92 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.845 0.355 . . . . 34.44 110.915 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 3.3 t -110.17 88.4 2.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 75.35 110.883 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -83.46 149.43 26.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.211 -0.45 . . . . 65.43 110.975 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.71 129.39 10.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 75.54 110.891 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.25 170.89 9.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.209 -0.45 . . . . 55.13 110.888 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -63.8 -15.58 59.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 72.31 110.914 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.47 -38.58 91.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 73.34 110.848 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -104.08 -26.14 12.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.876 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.515 ' HB2' HD11 ' B' ' 305' ' ' LEU . 31.0 m-20 -138.33 77.8 34.68 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.594 0.712 . . . . 64.32 110.897 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.73 -6.15 17.89 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.674 2.249 . . . . 64.12 112.308 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.3 t -93.64 27.27 2.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.434 . . . . 75.42 111.069 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.515 HD11 ' HB2' ' B' ' 302' ' ' ASP . 36.0 mt -103.11 136.65 42.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.269 -0.423 . . . . 72.5 110.997 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.65 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.7 t -107.12 173.69 6.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.438 . . . . 72.34 111.171 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 26.8 pt-20 -49.26 -37.63 24.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 72.32 110.793 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -61.38 -52.0 66.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 74.31 110.916 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.65 ' HG2' HG22 ' B' ' 306' ' ' THR . 9.1 mm-40 -63.29 -52.45 61.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 53.2 110.878 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.447 HD13 ' CE ' ' B' ' 313' ' ' MET . 46.2 mm -56.33 -54.06 32.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.468 . . . . 43.13 111.098 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 22.8 t -60.33 -19.92 57.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 75.31 110.882 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.0 3.0 28.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.092 -0.504 . . . . 43.25 111.102 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . 0.447 ' CE ' HD13 ' B' ' 310' ' ' ILE . 1.8 mtm . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 61.54 110.887 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 16.2 t . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.882 0.372 . . . . 74.12 110.838 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.44 139.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.475 . . . . 63.33 110.87 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.716 HG21 ' CB ' ' A' ' 141' ' ' ASP . 5.6 m -50.93 122.24 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 73.42 111.188 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -131.85 80.88 1.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.932 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.599 0.714 . . . . 71.53 110.917 179.928 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.466 -0.124 0 CA-C-O 120.764 0.235 . . . . 73.31 112.324 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.452 ' CH2' HG21 ' A' ' 153' ' ' VAL . 47.1 p-90 -54.54 -27.18 36.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.251 -0.431 . . . . 73.04 110.899 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -87.45 99.48 12.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 64.41 110.997 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.6 -39.62 57.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.16 -0.473 . . . . 75.3 110.914 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.65 23.91 38.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.788 -0.72 . . . . 71.0 112.557 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.53 70.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.798 0.332 . . . . 73.31 110.913 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.626 HG23 ' HB3' ' A' ' 91' ' ' GLN . 26.4 mm -138.95 145.14 28.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.425 . . . . 74.31 111.152 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.7 p -97.4 177.17 5.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.21 -0.45 . . . . 64.22 111.154 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -39.33 89.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.221 -0.445 . . . . 73.35 110.919 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -64.04 -37.54 87.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 71.22 110.884 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.626 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -76.13 -38.57 56.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 75.13 110.94 -179.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.27 -36.45 79.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 71.13 111.044 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.61 -53.15 30.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 73.04 110.88 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.99 -34.51 78.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 73.14 110.876 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.29 -35.69 81.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 73.25 110.89 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.618 HD12 ' HB3' ' A' ' 121' ' ' SER . 2.4 mm? -104.89 43.74 1.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 73.51 110.91 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.45 -59.94 5.37 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.604 0.716 . . . . 72.01 110.919 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.0 Cg_endo -69.81 122.66 9.32 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.647 2.232 . . . . 72.33 112.307 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 117.61 5.19 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.66 2.24 . . . . 63.21 112.369 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -154.99 103.48 2.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.196 -0.456 . . . . 75.32 110.938 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.681 ' O ' HD12 ' A' ' 168' ' ' ILE . 10.8 p -56.14 111.93 1.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.456 . . . . 54.33 111.186 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.54 -10.8 5.79 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.77 -0.728 . . . . 63.23 112.546 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -87.8 111.83 21.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.329 . . . . 74.5 110.923 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.454 ' HB3' HD22 ' A' ' 167' ' ' LEU . 23.4 p90 -123.79 162.09 23.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 73.23 110.889 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.559 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -157.65 136.58 11.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.117 -0.492 . . . . 74.34 110.985 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.442 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 88.6 t -109.6 139.54 32.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 65.24 111.23 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.417 ' NH2' HG21 ' A' ' 117' ' ' THR . 0.0 OUTLIER -151.91 144.55 24.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 62.11 110.805 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.74 124.05 10.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 41.53 110.926 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.3 m -59.47 118.75 6.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 65.25 110.941 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.643 HG21 ' HB2' ' B' ' 298' ' ' SER . 3.8 m -68.65 -56.38 8.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 75.02 111.215 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.545 ' CG ' HD12 ' B' ' 310' ' ' ILE . 1.2 m-80 -70.49 -29.21 65.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 70.42 110.915 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -107.88 92.72 9.42 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.665 0.745 . . . . 73.35 110.878 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 112.94 3.22 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.612 2.208 . . . . 62.31 112.399 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.54 -4.84 24.72 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.699 -0.763 . . . . 64.23 112.499 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -121.17 -178.9 3.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.824 0.345 . . . . 72.23 110.857 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . 0.512 ' HB2' HD12 ' A' ' 131' ' ' ILE . 60.0 m-85 -125.52 171.5 10.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.431 . . . . 73.14 110.94 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.417 HG21 ' NH2' ' A' ' 107' ' ' ARG . 99.2 m -139.42 122.82 17.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 52.04 111.126 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.43 112.49 25.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 72.33 110.89 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 42.9 t -101.33 124.14 46.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 65.33 110.879 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.8 t -121.75 150.21 25.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 72.45 111.115 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . 0.618 ' HB3' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -98.25 110.82 23.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 72.31 110.895 -179.832 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.04 90.35 3.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.127 -0.488 . . . . 64.43 110.937 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 66.1 32.78 7.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 74.32 110.856 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.48 -13.8 63.93 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.758 -0.734 . . . . 72.51 112.507 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -87.89 146.39 25.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.835 0.35 . . . . 55.12 110.9 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.658 ' O ' HD13 ' B' ' 294' ' ' LEU . 5.8 m -106.53 104.13 16.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.216 -0.447 . . . . 73.01 111.13 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -89.47 112.69 23.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 72.43 110.884 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -92.6 124.85 36.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 73.1 110.846 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.442 ' HB3' HD13 ' A' ' 140' ' ' ILE . 80.4 m-85 -118.36 106.71 13.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 73.33 110.93 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 6.7 ttp-105 -70.23 136.77 50.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.056 -0.52 . . . . 61.13 110.863 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.512 HD12 ' HB2' ' A' ' 116' ' ' TYR . 58.2 mt -110.83 108.42 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 75.5 111.153 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.65 124.79 26.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 64.41 110.937 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.462 ' CD2' HD21 ' A' ' 138' ' ' LEU . 0.1 OUTLIER -109.53 104.52 13.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 72.33 110.951 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -144.26 143.25 30.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.477 . . . . 73.11 110.913 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 60.39 39.93 18.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 63.22 111.128 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 56.87 24.09 8.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.254 -0.43 . . . . 72.43 110.843 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 7.3 mtmm -131.47 162.94 29.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.135 -0.484 . . . . 74.23 110.917 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.462 HD21 ' CD2' ' A' ' 133' ' ' TYR . 1.1 mt -124.52 148.57 47.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.214 -0.448 . . . . 75.04 110.943 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 7.2 t -166.44 145.75 5.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 64.33 110.908 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.55 HG22 HG13 ' B' ' 317' ' ' VAL . 56.1 mt -115.58 -28.75 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 73.31 111.123 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.622 ' HB3' HG21 ' B' ' 317' ' ' VAL . 4.3 p30 -101.25 12.76 36.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 73.04 110.906 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.441 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 7.1 pt-20 46.9 27.93 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 71.31 110.906 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -133.12 -37.77 0.97 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.49 . . . . 65.15 110.899 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 1.4 t -110.65 104.64 17.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.092 -0.503 . . . . 74.13 111.077 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -97.56 138.05 35.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 72.44 110.97 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . 0.575 ' CD1' HD12 ' A' ' 152' ' ' LEU . 43.8 m-85 -114.43 176.52 5.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 72.01 110.909 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.58 -14.58 18.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 55.03 110.904 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -165.51 172.18 12.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 72.11 110.899 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.614 HD13 HD22 ' A' ' 152' ' ' LEU . 0.1 OUTLIER -74.63 -22.4 58.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 73.12 110.91 179.988 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -62.73 -57.12 12.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 65.5 110.896 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.53 -36.3 83.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 62.13 110.976 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.614 HD22 HD13 ' A' ' 149' ' ' LEU . 0.9 OUTLIER -55.21 -53.22 58.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 63.23 110.932 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.558 HG13 HD12 ' A' ' 167' ' ' LEU . 67.2 t -60.77 -37.52 76.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 75.25 111.11 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -55.06 -39.02 68.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 74.32 110.832 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -71.78 -46.54 57.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 75.21 110.884 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.434 ' CD1' HD13 ' A' ' 163' ' ' LEU . 39.1 m-85 -66.37 -21.23 66.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 75.12 110.885 -179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 92.0 m -84.18 -31.28 25.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 73.13 111.131 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 61.7 m -78.29 -24.42 46.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 74.4 111.137 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -165.64 157.84 14.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 74.01 110.885 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -51.26 -58.26 6.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 70.31 111.089 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 53.92 27.54 7.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 71.51 110.855 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 118.88 3.99 13.13 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 53.41 112.509 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.464 ' O ' ' HB1' ' A' ' 160' ' ' ALA . 9.5 mp -106.67 140.95 38.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 73.14 110.871 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . 0.436 ' SG ' HG22 ' A' ' 165' ' ' THR . 18.2 p -54.44 -26.38 30.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 51.0 110.885 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.436 HG22 ' SG ' ' A' ' 164' ' ' CYS . 9.0 t -162.64 129.55 3.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 74.41 111.105 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -53.13 161.39 0.86 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 71.44 110.777 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.558 HD12 HG13 ' A' ' 153' ' ' VAL . 10.4 mt -79.21 141.41 37.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 65.42 110.886 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.681 HD12 ' O ' ' A' ' 101' ' ' THR . 23.1 mt -127.18 -51.4 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 75.21 111.167 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.6 mtpt -130.13 123.18 20.59 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.577 0.703 . . . . 73.34 110.937 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 138.3 37.6 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.721 2.281 . . . . 61.55 112.303 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.1 83.62 0.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 73.12 110.931 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 21.1 t -64.2 136.9 25.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 72.2 111.089 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.6 ptt? . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 75.35 110.87 179.888 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.658 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.872 0.367 . . . . 72.42 110.918 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 6.0 t -102.65 88.83 3.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 74.44 110.852 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -83.75 147.82 27.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.109 -0.496 . . . . 74.12 110.942 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -145.56 129.14 17.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.071 -0.513 . . . . 74.12 110.858 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . 0.643 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -88.52 162.16 16.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 42.15 110.917 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -62.2 -16.89 56.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 74.14 110.838 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -36.88 84.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.434 . . . . 72.04 110.882 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -98.32 -19.98 17.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.489 . . . . 63.54 110.87 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.513 ' HB2' HD11 ' B' ' 305' ' ' LEU . 53.1 m-20 -149.39 79.73 8.02 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.559 0.695 . . . . 63.54 110.791 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 -6.6 18.98 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.754 2.303 . . . . 71.23 112.315 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.6 t -94.11 27.27 2.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.44 . . . . 64.51 111.102 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.513 HD11 ' HB2' ' B' ' 302' ' ' ASP . 48.6 mt -100.24 136.92 39.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.225 -0.443 . . . . 62.53 110.933 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.618 HG22 ' HG2' ' B' ' 309' ' ' GLU . 12.0 t -107.75 174.53 5.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 61.52 111.133 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -50.07 -37.86 35.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.212 -0.449 . . . . 75.21 110.84 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -60.95 -49.71 76.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 74.54 110.925 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.618 ' HG2' HG22 ' B' ' 306' ' ' THR . 20.9 mm-40 -66.69 -51.95 50.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.159 -0.473 . . . . 73.41 110.945 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.545 HD12 ' CG ' ' A' ' 111' ' ' ASN . 44.6 mm -56.05 -53.75 35.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.119 -0.491 . . . . 64.1 111.094 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 82.8 p -59.8 -25.24 64.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 74.31 110.806 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -77.98 -2.66 38.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.48 . . . . 74.2 111.071 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 70.0 110.895 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.863 0.363 . . . . 73.11 110.871 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.29 155.65 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 74.42 110.865 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.622 HG21 ' HB3' ' A' ' 141' ' ' ASP . 4.7 m -51.38 121.31 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 65.42 111.13 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -135.92 74.96 1.53 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 52.42 110.797 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 22.1 mttt . . . . . 0 C--N 1.33 -0.275 0 CA-C-O 121.63 0.729 . . . . 62.04 110.875 179.893 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 C--O 1.231 0.167 0 CA-C-O 120.796 0.248 . . . . 64.23 112.348 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' TRP . . . . . 0.487 ' CH2' HG21 ' A' ' 153' ' ' VAL . 45.0 p-90 -100.09 -28.25 13.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 75.33 110.902 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -83.55 102.19 11.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.418 . . . . 74.23 110.888 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -75.57 -38.65 59.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 64.23 110.818 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 59.27 18.14 41.38 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.719 -0.753 . . . . 72.23 112.494 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.96 80.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.68 0.276 . . . . 72.52 110.871 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.595 HG23 ' HB3' ' A' ' 91' ' ' GLN . 26.5 mm -145.82 145.41 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.321 -0.399 . . . . 74.52 111.181 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -100.21 176.85 5.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 72.02 111.156 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -43.29 97.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.22 -0.446 . . . . 71.21 110.865 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.31 -37.74 78.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 73.21 110.871 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.595 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -76.51 -38.24 55.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 73.03 110.847 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.21 -38.47 85.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 63.42 111.106 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.88 -52.45 50.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 72.33 110.858 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -33.64 76.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 74.24 110.862 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 11.7 mt -60.74 -38.0 83.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 74.34 110.92 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.617 ' CD1' HD23 ' A' ' 105' ' ' LEU . 8.1 mp -105.77 43.18 1.15 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 71.42 110.891 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -61.39 -59.83 12.37 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.649 0.738 . . . . 74.42 110.917 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.77 124.2 10.85 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.695 2.263 . . . . 74.33 112.355 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.79 111.06 2.71 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.694 2.263 . . . . 75.03 112.273 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -148.99 123.28 9.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 64.43 110.954 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.687 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -72.97 111.66 8.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 63.03 111.174 -179.897 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.79 -7.81 6.13 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.786 -0.721 . . . . 63.43 112.47 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -87.4 111.63 21.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.852 0.358 . . . . 62.32 110.98 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -125.33 160.17 29.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 74.4 110.839 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.617 HD23 ' CD1' ' A' ' 96' ' ' LEU . 1.1 pp -156.09 134.71 11.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.112 -0.495 . . . . 73.32 110.92 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.518 HG22 HD12 ' A' ' 118' ' ' LEU . 91.9 t -109.52 141.22 25.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.171 -0.468 . . . . 53.41 111.101 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -153.58 149.94 28.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.474 . . . . 73.53 110.826 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.81 124.28 10.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.917 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.6 t -57.32 104.93 0.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 61.01 110.817 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.7 m -68.68 -30.04 68.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 50.23 111.083 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.656 HD22 HD12 ' B' ' 310' ' ' ILE . 0.1 OUTLIER -74.93 -30.55 61.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 61.35 110.928 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -139.64 116.09 8.3 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.636 0.731 . . . . 75.25 110.895 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 122.17 8.86 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.676 2.25 . . . . 62.13 112.349 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.4 -9.73 24.27 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.708 -0.758 . . . . 55.33 112.54 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -114.53 175.47 5.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.341 . . . . 62.22 110.871 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -132.57 146.55 51.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 73.33 110.911 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 3.3 m -116.71 138.84 51.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 74.12 111.097 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.518 HD12 HG22 ' A' ' 106' ' ' VAL . 0.8 OUTLIER -112.82 115.93 29.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.48 . . . . 73.32 110.919 179.954 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.4 m -99.87 120.17 39.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.261 -0.427 . . . . 53.25 110.875 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.4 t -121.99 146.97 26.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 65.32 111.174 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.43 110.45 22.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.229 -0.442 . . . . 75.13 110.794 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.1 98.05 6.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.092 -0.504 . . . . 75.44 110.904 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 66.22 28.29 10.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 75.01 110.86 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.35 -14.91 63.0 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.77 -0.729 . . . . 44.43 112.512 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt -87.58 139.03 30.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.342 . . . . 75.21 110.986 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.589 ' O ' HD13 ' B' ' 294' ' ' LEU . 11.0 m -99.67 109.68 25.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 71.22 111.124 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -100.98 130.74 47.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 74.33 110.826 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -105.9 131.47 53.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 72.05 110.852 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . 0.598 ' HB3' HD13 ' A' ' 140' ' ' ILE . 80.2 m-85 -115.94 115.74 26.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 73.13 110.892 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -70.55 125.29 26.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.52 . . . . 71.41 110.865 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.467 HG12 HD11 ' A' ' 140' ' ' ILE . 79.6 mt -107.07 108.9 26.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 60.41 111.172 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 4.2 ttt -76.27 129.44 36.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.111 -0.495 . . . . 73.2 110.792 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -111.89 116.65 30.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 74.13 110.926 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -151.11 135.99 17.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.488 . . . . 72.5 110.846 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.02 35.89 23.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.52 111.126 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.5 27.16 15.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 70.34 110.873 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.73 136.07 51.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 64.14 110.895 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.2 mp -101.52 150.15 23.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.174 -0.466 . . . . 74.1 110.89 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 53.3 p -167.95 131.81 1.68 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 73.24 110.895 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.598 HD13 ' HB3' ' A' ' 129' ' ' TYR . 60.7 mt -105.8 -33.5 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 53.34 111.117 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -85.24 -0.36 54.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 64.32 110.869 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 60.53 17.72 7.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 62.51 110.889 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -132.53 -38.55 1.03 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 43.14 110.932 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.8 t -101.99 104.5 16.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.1 -0.5 . . . . 72.44 111.166 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -99.87 143.38 30.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 65.25 110.975 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . 0.401 ' CE1' HD12 ' A' ' 152' ' ' LEU . 62.1 m-85 -115.82 174.56 5.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 71.31 110.909 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -100.87 -3.52 29.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 73.22 110.888 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -176.51 157.87 1.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 74.4 110.879 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.3 mp -59.18 -44.08 92.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 62.42 110.953 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -36.25 36.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 52.24 110.858 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -75.21 -45.49 40.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 75.23 110.941 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.401 HD12 ' CE1' ' A' ' 146' ' ' PHE . 0.4 OUTLIER -55.83 -42.52 75.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 61.53 110.961 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.516 HG13 HD12 ' A' ' 167' ' ' LEU . 75.5 t -66.6 -43.36 90.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 64.4 111.13 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -52.97 -37.34 61.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 62.52 110.915 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -72.3 -47.6 48.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 72.3 110.81 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.494 ' CD1' HD13 ' A' ' 163' ' ' LEU . 42.9 m-85 -68.35 -15.59 63.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 73.14 110.943 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.3 m -86.76 -33.98 19.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.079 -0.51 . . . . 71.54 111.135 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 3.9 m -78.08 -25.37 47.6 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 51.33 111.076 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -157.5 161.67 38.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.244 -0.434 . . . . 74.22 110.853 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.65 -54.49 22.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 61.31 111.092 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 59.81 20.46 9.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 64.15 110.868 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 109.18 12.19 20.53 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.713 -0.756 . . . . 53.44 112.397 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.494 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.3 mp -105.89 136.93 44.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.794 0.331 . . . . 75.34 110.965 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 11.5 t -51.57 -29.69 18.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 72.54 110.812 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.527 ' HB ' HG22 ' A' ' 101' ' ' THR . 1.9 t -152.67 120.24 6.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 64.01 111.118 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -50.97 146.1 6.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 75.05 110.901 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.516 HD12 HG13 ' A' ' 153' ' ' VAL . 7.0 mt -63.48 132.17 50.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 71.23 110.898 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' ILE . . . . . 0.687 HD12 ' O ' ' A' ' 101' ' ' THR . 23.9 mt -126.97 -51.39 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 73.41 111.184 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.3 mttm -123.87 119.25 26.83 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.54 0.686 . . . . 74.13 110.843 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 134.78 28.89 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.742 2.295 . . . . 55.24 112.362 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.99 84.46 0.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 63.55 110.898 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.7 m -64.42 129.89 28.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.221 -0.445 . . . . 70.42 111.153 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.6 mtt . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.24 -0.436 . . . . 71.1 110.914 179.861 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 294' ' ' LEU . . . . . 0.589 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.856 0.36 . . . . 71.14 110.983 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 6.2 t -82.95 89.07 6.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 70.14 110.868 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -79.95 148.42 31.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 75.21 110.917 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.21 128.53 13.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 73.1 110.935 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 20.3 m -89.57 162.14 15.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.292 -0.413 . . . . 62.13 110.888 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -59.33 -19.8 49.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 74.12 110.857 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -36.7 82.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 63.34 110.852 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -102.58 -10.56 19.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 63.11 110.933 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 302' ' ' ASP . . . . . 0.524 ' HB2' HD11 ' B' ' 305' ' ' LEU . 44.7 m-20 -157.58 78.6 3.56 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.662 0.744 . . . . 64.53 110.937 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.64 -6.7 19.17 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.77 2.314 . . . . 75.12 112.351 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 15.2 t -93.74 27.54 2.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.213 -0.449 . . . . 65.11 111.168 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 305' ' ' LEU . . . . . 0.524 HD11 ' HB2' ' B' ' 302' ' ' ASP . 44.0 mt -101.74 138.25 38.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 75.41 110.955 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 306' ' ' THR . . . . . 0.609 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.8 t -107.52 172.97 6.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 74.52 111.132 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -50.09 -31.98 14.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.451 . . . . 62.15 110.967 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 308' ' ' GLU . . . . . 0.462 ' H ' HG23 ' B' ' 306' ' ' THR . 0.6 OUTLIER -66.72 -45.8 77.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.099 -0.501 . . . . 44.45 110.87 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 309' ' ' GLU . . . . . 0.609 ' HG2' HG22 ' B' ' 306' ' ' THR . 19.3 mm-40 -70.31 -51.67 28.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 52.54 110.872 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 310' ' ' ILE . . . . . 0.656 HD12 HD22 ' A' ' 111' ' ' ASN . 40.5 mm -55.72 -53.09 41.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 60.24 111.189 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 35.0 t -63.97 -25.62 68.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 71.1 110.879 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 312' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' B' ' 308' ' ' GLU . . . -71.16 -9.75 58.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 74.11 111.144 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 72.3 110.902 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 86.1 p . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.902 0.382 . . . . 73.23 110.902 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 65.54 147.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 75.14 110.857 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 317' ' ' VAL . . . . . 0.404 HG23 ' O ' ' B' ' 317' ' ' VAL . 12.3 m -51.23 116.84 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.084 -0.507 . . . . 74.32 111.164 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -125.24 75.04 1.42 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 64.53 110.839 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.616 0.722 . . . . 73.25 110.875 179.904 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 CA-C-O 121.428 0.46 . . . . 61.53 112.477 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -44.99 1.8 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.685 2.257 . . . . 44.01 112.36 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -156.55 39.73 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.457 . . . . 70.03 110.917 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.08 -100.72 0.28 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.712 -0.756 . . . . 50.32 112.485 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 77.7 p -164.29 64.5 0.15 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.832 0.348 . . . . 74.41 110.871 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -126.32 68.59 66.71 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.652 0.739 . . . . 74.25 110.873 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -33.14 17.42 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.731 2.287 . . . . 75.32 112.319 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.444 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 48.9 p-90 -54.86 -26.32 34.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 64.14 110.915 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -89.17 100.55 13.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.27 -0.423 . . . . 71.11 110.885 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 -75.62 -37.06 60.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 75.54 110.834 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 56.24 20.56 29.27 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.703 -0.76 . . . . 65.31 112.501 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.32 79.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.684 0.278 . . . . 64.31 110.857 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.594 HG23 ' HB3' ' A' ' 91' ' ' GLN . 24.4 mm -144.19 144.82 22.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 75.43 111.076 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 p -96.57 177.08 5.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 34.44 111.167 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -66.03 -39.04 89.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.278 -0.419 . . . . 73.55 110.811 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -69.59 -34.75 74.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.219 -0.446 . . . . 71.3 110.893 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.594 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -75.34 -36.63 61.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 64.4 110.899 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.06 -34.0 61.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 64.24 111.028 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.24 -53.4 37.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.234 -0.439 . . . . 61.5 110.855 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -62.87 -39.17 93.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 74.44 110.916 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 17.3 mt -57.5 -38.44 74.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 74.24 110.913 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.626 HD12 ' CB ' ' A' ' 121' ' ' SER . 2.7 mm? -101.89 43.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 73.34 110.931 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.487 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.93 -60.35 4.48 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.674 0.75 . . . . 75.34 110.982 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.71 123.13 9.82 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.735 2.29 . . . . 62.52 112.341 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 118.08 5.47 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.713 2.275 . . . . 64.34 112.273 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.89 104.4 2.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.445 . . . . 71.11 110.888 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 168' ' ' ILE . 2.6 p -56.82 111.93 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.108 -0.496 . . . . 71.41 111.143 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.85 -8.83 6.09 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.718 -0.753 . . . . 45.24 112.435 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.7 tp -89.74 111.78 22.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.84 0.352 . . . . 62.0 110.901 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -123.75 163.9 20.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 74.32 110.857 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.547 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -159.2 136.99 10.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.213 -0.449 . . . . 73.42 110.918 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.444 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 86.3 t -110.23 137.38 42.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.166 -0.47 . . . . 64.52 111.125 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -150.69 145.58 25.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 73.35 110.912 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.5 124.09 11.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 65.33 110.958 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.9 t -60.46 114.42 2.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.184 -0.462 . . . . 74.4 110.851 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.465 HG21 ' HB2' ' B' ' 298' ' ' SER . 2.3 m -68.73 -53.17 23.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 63.23 111.143 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.634 ' CG ' HD12 ' B' ' 310' ' ' ILE . 37.1 m-80 -63.49 -29.38 70.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 71.41 110.862 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -125.97 96.11 38.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.667 0.746 . . . . 73.13 110.947 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.66 127.09 14.17 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.69 2.26 . . . . 73.42 112.314 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.4 -15.72 22.37 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.72 -0.752 . . . . 51.01 112.472 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -117.59 179.23 4.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.89 0.376 . . . . 73.15 110.868 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . 0.638 ' CE2' HD21 ' A' ' 149' ' ' LEU . 55.7 m-85 -124.68 162.81 23.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.118 -0.492 . . . . 75.21 110.924 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.487 HG23 ' HE1' ' B' ' 314' ' ' PTR . 89.8 m -134.72 126.45 29.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.122 -0.49 . . . . 65.51 111.136 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.23 119.83 37.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.915 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.5 t -105.94 122.44 46.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 73.04 110.902 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.7 t -122.67 151.01 26.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.268 -0.423 . . . . 71.53 111.121 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.626 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -103.54 111.0 23.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.868 -179.858 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.47 94.59 4.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 71.53 110.881 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 66.23 29.88 9.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 72.4 110.905 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.87 -13.17 63.93 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.72 -0.753 . . . . 72.33 112.492 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -88.01 140.06 29.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.836 0.35 . . . . 73.12 110.906 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.448 ' O ' HG23 ' A' ' 126' ' ' VAL . 8.8 m -101.25 107.88 22.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.262 -0.426 . . . . 63.13 111.111 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -97.05 123.05 40.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 74.32 110.865 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 70.2 m-70 -102.41 125.17 49.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 74.45 110.895 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -113.01 112.56 24.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 72.42 110.924 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.37 132.79 48.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.092 -0.504 . . . . 63.42 110.884 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.523 HG12 HD11 ' A' ' 140' ' ' ILE . 29.3 mt -113.19 110.1 30.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.224 -0.444 . . . . 74.44 111.18 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.04 128.56 34.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 62.1 110.904 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.448 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -115.42 101.37 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.411 . . . . 75.01 110.888 -179.863 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -136.49 142.57 43.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.147 -0.479 . . . . 74.21 110.848 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.14 35.96 25.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 73.01 111.169 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.28 29.6 19.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 73.03 110.825 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -136.23 142.3 44.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.08 -0.509 . . . . 74.05 110.905 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.448 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 4.1 mp -103.86 150.06 24.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.25 -0.432 . . . . 70.04 110.9 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 33.8 t -167.37 140.45 3.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.161 -0.472 . . . . 74.22 110.846 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.596 HG22 HG13 ' B' ' 317' ' ' VAL . 58.9 mt -115.7 -28.76 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.143 -0.481 . . . . 60.3 111.125 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.59 ' HA ' HG21 ' B' ' 317' ' ' VAL . 6.1 p30 -95.28 -1.74 50.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 75.14 110.875 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 61.57 17.03 8.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 64.4 110.862 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -127.49 -33.99 2.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 35.43 110.882 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -112.21 104.58 17.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.112 -0.494 . . . . 63.32 111.09 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -97.79 143.98 27.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.253 -0.43 . . . . 71.54 111.01 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.529 ' CD1' HD12 ' A' ' 152' ' ' LEU . 51.3 m-85 -118.55 178.07 4.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 71.2 110.875 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.55 -15.44 17.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 71.43 110.859 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -165.39 172.27 12.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.175 -0.466 . . . . 71.02 110.93 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.638 HD21 ' CE2' ' A' ' 116' ' ' TYR . 0.7 OUTLIER -74.63 -24.78 58.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.168 -0.469 . . . . 75.25 110.909 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.3 tmm? -61.54 -57.09 13.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.271 -0.422 . . . . 61.44 110.903 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.65 -36.1 82.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 63.31 110.94 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.529 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.69 -48.27 75.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.439 . . . . 73.05 110.92 179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.52 HG13 HD12 ' A' ' 167' ' ' LEU . 73.6 t -64.84 -37.43 80.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 72.51 111.19 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -56.1 -38.12 70.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 74.21 110.887 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.09 -44.33 63.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.47 . . . . 75.5 110.879 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -71.1 -16.14 62.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 62.52 110.925 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 95.4 m -87.02 -33.3 19.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.501 . . . . 72.34 111.123 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.4 t -80.52 -24.29 39.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 63.41 111.153 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -157.47 155.01 29.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 71.13 110.845 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.18 -57.46 8.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 73.32 111.102 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 60.01 20.75 9.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 70.01 110.866 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.78 17.24 7.54 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.756 -0.735 . . . . 75.22 112.507 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 9.7 mp -111.18 139.13 46.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.833 0.349 . . . . 72.03 110.935 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 38.4 t -51.37 -31.76 23.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 55.41 110.904 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 5.3 t -156.02 124.42 5.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.15 -0.477 . . . . 33.14 111.174 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -51.43 146.87 6.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 73.13 110.78 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.52 HD12 HG13 ' A' ' 153' ' ' VAL . 7.7 mt -65.74 138.45 57.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.144 -0.48 . . . . 73.34 110.901 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 101' ' ' THR . 26.4 mt -127.24 -51.31 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.168 -0.469 . . . . 73.21 111.132 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 1.8 mmtp -129.2 121.98 20.87 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.605 0.717 . . . . 71.4 110.902 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 138.24 37.6 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.718 2.278 . . . . 62.42 112.3 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.46 83.36 0.58 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 65.05 110.88 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.5 m -64.46 134.91 28.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 63.43 111.148 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.5 ptm . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 51.54 110.853 179.943 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.374 0 CA-C-O 121.494 0.497 . . . . 45.03 112.546 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.66 167.86 23.08 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.7 2.267 . . . . 63.22 112.323 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 10.3 mp -52.94 -42.47 65.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.135 -0.484 . . . . 63.1 110.884 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 87.53 29.37 21.85 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.7 -0.762 . . . . 73.11 112.474 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 7.1 t -88.4 57.03 4.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.904 0.383 . . . . 73.21 110.818 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -131.15 135.75 47.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 62.34 110.902 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 6.0 mtm180 -100.26 105.85 17.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 62.0 110.883 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -171.04 131.94 0.82 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 75.03 110.832 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.46 105.54 6.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 73.24 110.82 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 37.2 p -59.42 -178.95 0.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 73.52 110.886 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.437 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER -158.05 99.59 1.67 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 62.1 110.944 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.6 t -96.2 88.95 4.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 53.23 110.882 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -71.47 147.09 48.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.149 -0.478 . . . . 51.31 110.869 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.06 129.48 21.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.11 -0.495 . . . . 72.11 110.869 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . 0.465 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -93.86 161.29 14.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 33.05 110.851 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -61.33 -17.74 55.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.103 -0.499 . . . . 74.15 110.875 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -36.99 84.62 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.132 -0.485 . . . . 73.44 110.914 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -100.33 -20.61 15.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 74.34 110.933 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.514 ' HB2' HD11 ' B' ' 305' ' ' LEU . 23.8 m-20 -147.82 79.07 9.52 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.619 0.724 . . . . 63.54 110.825 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -6.54 18.85 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.678 2.252 . . . . 72.12 112.35 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.3 t -94.05 27.47 2.81 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.23 -0.441 . . . . 62.41 111.129 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' B' ' 302' ' ' ASP . 47.6 mt -100.64 136.94 39.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.247 -0.433 . . . . 72.4 110.875 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.607 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.2 t -108.96 172.34 6.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 62.41 111.158 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -48.98 -34.16 12.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.2 -0.455 . . . . 71.0 110.93 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . 0.418 ' H ' HG23 ' B' ' 306' ' ' THR . 2.7 mt-10 -64.28 -45.09 89.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 72.32 110.895 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.607 ' HG2' HG22 ' B' ' 306' ' ' THR . 10.4 mm-40 -74.31 -50.21 19.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.49 . . . . 71.14 110.847 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.634 HD12 ' CG ' ' A' ' 111' ' ' ASN . 40.6 mm -55.69 -53.05 41.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 62.42 111.131 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 25.0 m -62.74 -32.48 73.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 54.11 110.851 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -62.88 -16.56 59.27 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.146 -0.479 . . . . 75.15 111.145 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -97.88 14.02 28.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 53.34 110.905 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.487 ' HE1' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 2.1 t -100.62 -33.19 10.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.117 -1.401 . . . . 74.01 110.864 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 3.1 m 63.88 158.03 0.08 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 61.23 110.876 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.596 HG13 HG22 ' A' ' 140' ' ' ILE . 4.7 m -51.61 123.21 2.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.145 -0.479 . . . . 63.44 111.196 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -137.87 77.67 1.64 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 73.2 110.852 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -52.27 156.86 2.6 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.534 0.683 . . . . 75.54 110.957 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.68 112.64 3.12 Favored 'Trans proline' 0 N--CA 1.465 -0.177 0 C-N-CA 122.691 2.261 . . . . 64.42 112.407 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 CA-C-O 119.138 -0.812 . . . . 71.02 112.484 179.993 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 CA-C-O 121.477 0.487 . . . . 70.32 112.512 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -41.69 4.06 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.662 2.242 . . . . 33.24 112.323 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.4 mt -115.39 -30.8 6.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.22 -0.445 . . . . 74.22 110.941 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.57 -69.64 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.772 -0.728 . . . . 71.12 112.519 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.3 t -152.19 60.38 0.84 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 72.13 110.907 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -134.29 73.88 68.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.646 0.736 . . . . 62.41 110.859 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -7.97 22.42 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.689 2.26 . . . . 53.41 112.316 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.415 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 38.0 p-90 -102.76 -30.13 11.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 75.43 110.871 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -87.42 97.22 10.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 75.42 110.908 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.77 -37.48 59.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 72.02 110.894 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.7 25.94 56.57 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.704 -0.76 . . . . 54.24 112.474 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.26 67.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.726 0.298 . . . . 72.21 110.91 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 15.5 mm -128.41 144.12 38.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 73.21 111.111 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.459 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -94.87 171.23 8.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.153 -0.476 . . . . 74.33 111.198 179.904 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.459 ' H ' HG22 ' A' ' 88' ' ' THR . 7.1 ppt_? -62.03 -39.08 91.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 74.45 110.829 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -75.15 -32.8 61.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 55.54 110.952 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -69.97 -41.38 74.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.161 -0.472 . . . . 73.22 110.888 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.606 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -74.26 -36.55 63.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.252 -0.431 . . . . 71.34 111.051 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.64 -53.21 60.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 75.32 110.887 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.45 -34.08 76.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 71.3 110.884 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.606 HD12 ' HA ' ' A' ' 92' ' ' ALA . 9.5 mt -54.88 -38.42 67.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 71.14 110.938 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.775 HD21 HD23 ' A' ' 105' ' ' LEU . 3.9 mm? -100.27 43.57 1.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 70.5 110.894 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.514 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.38 -59.47 4.91 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.712 0.768 . . . . 72.43 110.902 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 52.7 Cg_endo -69.78 123.74 10.39 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.74 2.294 . . . . 73.11 112.304 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 115.63 4.19 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.639 2.226 . . . . 73.2 112.3 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -155.34 121.03 5.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.254 -0.43 . . . . 62.24 110.871 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.682 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.8 OUTLIER -72.39 111.74 7.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.097 -0.501 . . . . 64.03 111.128 -179.906 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.28 -4.32 6.76 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.696 -0.764 . . . . 51.24 112.481 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.544 HD12 ' O ' ' A' ' 169' ' ' LYS . 3.8 tp -90.24 120.92 31.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.908 0.385 . . . . 75.23 110.895 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.463 ' HB3' HD22 ' A' ' 167' ' ' LEU . 23.7 p90 -133.05 175.94 8.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.118 -0.492 . . . . 65.12 110.919 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.775 HD23 HD21 ' A' ' 96' ' ' LEU . 0.9 OUTLIER -169.47 134.27 1.43 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 74.25 110.863 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.415 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 84.7 t -110.93 131.4 62.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 34.3 111.161 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.66 150.81 36.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 74.5 110.863 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -57.5 124.08 17.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 74.53 110.927 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.5 m -57.94 117.1 3.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 72.31 110.868 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 67.9 m -69.01 -56.17 8.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 64.32 111.071 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -71.97 -26.76 62.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 63.02 110.913 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -108.42 90.63 7.31 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.655 0.74 . . . . 62.13 110.922 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 113.56 3.41 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.71 2.273 . . . . 73.03 112.339 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.44 2.62 24.4 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.704 -0.76 . . . . 73.24 112.512 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -130.78 -172.62 2.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.82 0.343 . . . . 71.11 110.853 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -140.52 145.23 36.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.882 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.407 HG23 ' HE1' ' B' ' 314' ' ' PTR . 31.6 m -108.95 128.22 54.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.49 . . . . 64.32 111.12 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.488 HD23 ' HB2' ' A' ' 129' ' ' TYR . 0.4 OUTLIER -110.86 104.7 13.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 72.22 110.916 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.3 m -87.21 153.91 21.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.185 -0.461 . . . . 64.04 110.843 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.633 HG21 HD12 ' A' ' 163' ' ' LEU . 12.8 t -146.58 142.66 20.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.155 -0.475 . . . . 64.12 111.192 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.62 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.3 OUTLIER -92.13 111.29 22.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.178 -0.465 . . . . 64.55 110.803 -179.803 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -123.23 93.55 3.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 75.44 110.905 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 67.5 29.27 7.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.456 . . . . 71.33 110.837 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.68 -19.05 56.18 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.741 -0.742 . . . . 52.1 112.464 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -87.44 136.68 32.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.851 0.358 . . . . 73.15 110.891 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.52 ' O ' HD13 ' B' ' 294' ' ' LEU . 4.1 p -97.26 106.73 18.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 74.43 111.105 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -91.95 120.19 32.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.123 -0.49 . . . . 64.4 110.924 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -87.79 124.72 33.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 72.43 110.878 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.686 ' CZ ' HD13 ' A' ' 163' ' ' LEU . 57.0 m-85 -114.14 106.8 14.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 75.4 110.919 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -64.06 141.28 58.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 73.31 110.905 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.433 HG21 HD23 ' A' ' 138' ' ' LEU . 61.9 mt -123.25 111.25 28.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 64.43 111.13 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.32 125.07 31.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 65.3 110.862 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.492 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -111.77 98.27 7.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 75.31 110.947 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -130.83 142.56 50.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 44.44 110.872 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.2 35.96 25.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 73.14 111.182 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.44 29.32 18.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.473 . . . . 62.31 110.861 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mtmm -134.1 139.93 46.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 65.34 110.91 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.492 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 4.8 mp -102.01 149.21 24.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.271 -0.422 . . . . 70.34 110.934 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.2 p -165.69 140.57 4.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 71.11 110.901 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.532 HG22 HG13 ' B' ' 317' ' ' VAL . 50.1 mt -115.56 -32.5 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 73.12 111.155 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.561 ' HA ' HG21 ' B' ' 317' ' ' VAL . 40.3 t0 -89.64 1.14 56.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 75.42 110.918 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 60.53 17.81 7.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.18 -0.464 . . . . 74.55 110.865 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -132.43 -38.59 1.04 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 73.12 110.88 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.48 104.6 16.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.489 . . . . 71.53 111.104 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -99.95 144.58 28.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.139 -0.482 . . . . 73.12 110.933 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.482 ' CD1' HD12 ' A' ' 152' ' ' LEU . 57.7 m-85 -117.89 177.77 4.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 74.41 110.896 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.65 -15.31 17.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 74.32 110.919 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -166.06 172.13 11.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 75.5 110.933 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.6 -24.45 58.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.202 -0.454 . . . . 73.14 110.943 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.88 -56.94 14.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 71.11 110.904 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.95 -35.33 80.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 65.14 110.917 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.482 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.59 -52.4 63.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.18 -0.463 . . . . 62.24 110.924 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.696 HG13 HD12 ' A' ' 167' ' ' LEU . 85.3 t -62.77 -36.63 76.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 44.03 111.099 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -55.51 -39.09 70.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 41.02 110.856 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -72.08 -44.18 63.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 64.54 110.857 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.405 ' CD1' HD23 ' A' ' 163' ' ' LEU . 30.2 m-85 -67.91 -21.94 65.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.445 . . . . 50.12 110.929 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.529 HG23 ' O ' ' A' ' 167' ' ' LEU . 63.0 m -84.57 -30.2 25.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.081 -0.508 . . . . 71.1 111.172 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 93.5 m -79.84 -24.01 41.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.191 -0.459 . . . . 75.42 111.18 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -163.15 159.54 23.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 72.33 110.835 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.25 -57.99 7.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 73.23 111.047 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 57.04 24.18 9.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.212 -0.449 . . . . 72.33 110.891 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 112.75 0.89 25.86 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.707 -0.759 . . . . 75.13 112.471 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.686 HD13 ' CZ ' ' A' ' 129' ' ' TYR . 4.0 mm? -95.71 136.22 36.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.923 0.392 . . . . 41.44 110.922 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 49.3 t -51.82 -28.94 17.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.15 -0.477 . . . . 64.24 110.908 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.2 t -156.97 123.46 4.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.123 -0.489 . . . . 64.5 111.102 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -51.49 139.99 18.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.231 -0.44 . . . . 70.51 110.892 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.696 HD12 HG13 ' A' ' 153' ' ' VAL . 8.6 mt -62.32 135.81 57.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 73.42 110.946 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.682 HD12 ' O ' ' A' ' 101' ' ' THR . 29.3 mt -127.05 -51.4 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.431 . . . . 75.13 111.18 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . 0.544 ' O ' HD12 ' A' ' 103' ' ' LEU . 21.3 mttt -126.88 118.29 22.34 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.574 0.702 . . . . 74.24 110.881 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 138.15 37.15 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.757 2.305 . . . . 73.41 112.373 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . 0.409 ' HD3' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -68.18 84.9 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 55.22 110.913 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 33.9 m -64.34 138.8 22.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 73.43 111.174 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.1 ptm . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 74.05 110.854 179.892 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 CA-C-O 121.474 0.486 . . . . 52.25 112.456 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.71 165.7 30.04 Favored 'Trans proline' 0 N--CA 1.464 -0.207 0 C-N-CA 122.745 2.296 . . . . 70.03 112.372 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.06 -40.82 64.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.262 -0.427 . . . . 72.54 110.86 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 91.61 23.09 29.43 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.763 -0.732 . . . . 74.23 112.47 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 3.2 m -101.84 127.24 48.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.921 0.391 . . . . 64.02 110.931 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -153.9 173.27 16.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 74.13 110.914 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.79 115.94 20.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.272 -0.422 . . . . 71.21 110.804 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -175.45 126.9 0.25 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.12 -0.491 . . . . 62.23 110.891 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 91.5 p -114.83 89.87 3.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 72.11 110.834 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 89.1 p -60.29 -172.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 61.32 110.799 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.7 OUTLIER -163.84 103.88 0.91 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.098 -0.501 . . . . 74.25 110.919 179.955 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 28.4 t -92.47 88.65 6.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 73.34 110.856 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -71.62 147.69 47.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.167 -0.47 . . . . 70.02 110.934 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . 0.4 ' HB2' ' HE1' ' B' ' 313' ' ' MET . 1.5 mtpp -154.0 129.46 9.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 72.43 110.921 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.61 175.3 5.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 71.43 110.887 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 41.8 mtt180 -63.7 -16.0 59.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.175 -0.466 . . . . 75.41 110.913 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.04 -42.12 98.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 74.03 110.903 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -103.12 -15.55 16.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 74.32 110.925 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.528 ' HB2' HD11 ' B' ' 305' ' ' LEU . 5.4 m-20 -151.37 78.16 7.13 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.551 0.691 . . . . 75.11 110.801 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 -6.28 18.25 Favored 'Trans proline' 0 C--O 1.232 0.22 0 C-N-CA 122.606 2.204 . . . . 74.54 112.326 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.7 t -93.4 27.23 2.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 70.33 111.096 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.528 HD11 ' HB2' ' B' ' 302' ' ' ASP . 36.8 mt -103.48 137.81 41.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.217 -0.447 . . . . 72.03 110.888 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.606 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -103.48 173.52 6.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 72.13 111.118 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.87 -35.23 22.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 74.31 110.838 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . 0.409 ' H ' HG23 ' B' ' 306' ' ' THR . 6.0 tt0 -63.28 -48.32 78.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.187 -0.461 . . . . 62.25 110.927 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.606 ' HG2' HG22 ' B' ' 306' ' ' THR . 2.9 mm-40 -66.43 -52.27 48.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 74.11 110.897 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 45.8 mm -56.82 -45.75 83.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 60.54 111.12 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 32.6 p -72.5 -15.94 61.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.256 -0.429 . . . . 71.35 110.904 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -81.98 1.75 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.119 -0.491 . . . . 74.34 111.115 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . 0.4 ' HE1' ' HB2' ' B' ' 297' ' ' LYS . 2.3 mtt -115.25 14.51 16.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.24 -0.436 . . . . 72.4 110.833 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.407 ' HE1' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 27.3 t -115.35 -35.13 4.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.171 -1.377 . . . . 73.44 110.935 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 6.0 t 65.06 150.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.089 -0.505 . . . . 75.31 110.9 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.561 HG21 ' HA ' ' A' ' 141' ' ' ASP . 4.3 m -51.64 123.07 2.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.094 -0.503 . . . . 73.25 111.121 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -134.49 75.0 1.56 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.485 . . . . 75.12 110.875 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.1 mtmp? -55.57 160.55 3.8 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.571 0.7 . . . . 73.13 110.857 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 111.03 2.71 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.67 2.247 . . . . 74.12 112.271 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.361 0 CA-C-O 119.126 -0.819 . . . . 62.43 112.509 179.939 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.308 0 CA-C-O 121.424 0.458 . . . . 71.3 112.515 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 -42.15 3.73 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.673 2.249 . . . . 72.33 112.374 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.87 28.26 3.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 72.42 110.958 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.09 -105.89 0.35 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.678 -0.772 . . . . 75.33 112.454 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 67.6 m -148.93 63.52 1.05 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.882 0.372 . . . . 61.25 110.852 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -138.14 68.32 48.35 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.606 0.717 . . . . 73.22 110.797 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -32.92 17.7 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.717 2.278 . . . . 72.13 112.412 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.451 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 49.5 p-90 -54.89 -25.68 30.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.19 -0.459 . . . . 63.34 110.921 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -90.36 99.22 12.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 73.31 110.881 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -75.89 -40.69 53.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.119 -0.491 . . . . 72.35 110.778 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.83 24.84 54.91 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.732 -0.747 . . . . 70.13 112.512 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.79 65.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.815 0.34 . . . . 62.11 110.93 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.475 ' CG2' ' HB2' ' A' ' 92' ' ' ALA . 12.3 mm -129.73 144.21 38.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.145 -0.48 . . . . 63.12 111.081 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.456 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -99.77 177.17 5.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 75.1 111.175 179.878 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.456 ' H ' HG22 ' A' ' 88' ' ' THR . 2.3 ppt_? -64.59 -40.84 96.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 73.23 110.88 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -71.53 -34.74 70.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.439 . . . . 74.42 110.869 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -73.29 -42.27 62.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 61.04 110.882 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 87' ' ' ILE . . . -74.17 -33.81 63.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 74.4 111.098 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.496 ' OE2' HG21 ' A' ' 126' ' ' VAL . 24.0 mm-40 -62.2 -53.25 57.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.24 -0.436 . . . . 53.44 110.857 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -35.01 79.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.843 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 12.9 mt -59.09 -36.19 74.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 74.22 110.917 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.635 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -104.43 43.48 1.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 61.31 110.9 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.56 -59.98 5.22 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.675 0.75 . . . . 65.45 110.94 -179.999 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.5 Cg_endo -69.86 123.51 10.14 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.641 2.227 . . . . 74.53 112.311 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 117.35 5.03 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.608 2.206 . . . . 62.13 112.379 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -154.84 115.2 3.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 65.1 110.863 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.643 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.2 OUTLIER -66.53 111.91 3.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 63.11 111.2 -179.908 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.5 -6.47 6.26 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.695 -0.764 . . . . 64.01 112.452 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.6 tp -90.47 111.75 23.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.83 0.347 . . . . 63.02 110.936 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.501 ' HB3' HD22 ' A' ' 167' ' ' LEU . 22.3 p90 -124.43 163.66 21.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.462 . . . . 71.43 110.866 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.587 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -159.49 137.11 9.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.478 . . . . 74.31 110.902 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.451 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 92.2 t -110.22 137.89 40.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 75.13 111.157 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.71 145.76 26.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.148 -0.478 . . . . 65.02 110.938 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -51.9 124.22 12.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 61.15 110.881 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.7 m -58.31 110.96 1.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 61.15 110.81 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.502 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.8 m -68.82 -54.67 14.49 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 72.1 111.161 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.625 ' CG ' HD12 ' B' ' 310' ' ' ILE . 34.2 m-80 -63.72 -27.92 69.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 72.31 110.859 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.418 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 5.2 m-85 -123.14 95.28 46.05 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.659 0.742 . . . . 74.24 110.898 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.9 Cg_endo -69.7 122.64 9.33 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.672 2.248 . . . . 73.33 112.364 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.49 -2.32 24.94 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.745 -0.741 . . . . 55.34 112.476 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -131.09 -175.94 3.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.856 0.36 . . . . 73.54 110.822 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -131.54 164.57 25.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.915 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.429 HG23 ' HE2' ' B' ' 314' ' ' PTR . 98.8 m -135.93 139.48 43.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 53.43 111.134 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.448 HD23 ' CD1' ' A' ' 129' ' ' TYR . 0.4 OUTLIER -109.98 117.18 33.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.199 -0.455 . . . . 75.13 110.95 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.3 m -101.52 123.93 46.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 71.02 110.896 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.3 t -123.12 151.72 27.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 73.34 111.136 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.635 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -101.09 111.59 23.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 73.43 110.882 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.43 91.04 3.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.13 -0.486 . . . . 72.15 110.943 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 67.12 30.72 7.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 74.35 110.826 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.95 -14.83 62.4 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.822 -0.704 . . . . 31.1 112.505 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.3 ptpt -88.11 140.18 29.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.813 0.34 . . . . 64.14 110.885 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.519 ' O ' HD22 ' B' ' 294' ' ' LEU . 8.6 m -99.94 108.9 23.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.253 -0.431 . . . . 63.13 111.085 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -95.9 121.8 38.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 71.55 110.929 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -99.73 124.67 45.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 65.54 110.892 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.448 ' CD1' HD23 ' A' ' 118' ' ' LEU . 74.1 m-85 -111.13 117.23 32.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 74.54 110.92 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -67.64 132.29 47.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 71.35 110.871 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.457 ' CG2' HD23 ' A' ' 138' ' ' LEU . 55.1 mt -113.56 107.57 23.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 74.12 111.116 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.9 ttm -83.92 122.56 28.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.19 -0.459 . . . . 62.33 110.902 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.448 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -111.29 99.4 8.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 53.32 110.913 -179.845 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -133.44 142.54 48.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 75.33 110.927 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 57.21 35.96 26.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.298 -0.41 . . . . 75.54 111.126 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.7 t 60.85 28.12 17.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 61.32 110.91 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.12 140.67 45.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 75.23 110.902 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.457 HD23 ' CG2' ' A' ' 131' ' ' ILE . 4.0 mp -102.2 147.65 26.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 65.53 110.911 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.95 137.66 5.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 53.04 110.828 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.502 HG22 HG13 ' B' ' 317' ' ' VAL . 51.0 mt -113.35 -31.93 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 74.24 111.152 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.564 ' HA ' HG21 ' B' ' 317' ' ' VAL . 40.7 t0 -90.52 1.2 56.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 71.55 110.894 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 60.62 17.81 7.81 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 60.5 110.899 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -132.43 -38.7 1.04 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 65.42 110.912 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.27 104.64 16.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 44.23 111.141 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -100.0 143.26 30.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 73.34 110.86 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.509 ' CD1' HD12 ' A' ' 152' ' ' LEU . 60.3 m-85 -117.83 175.14 5.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 73.1 110.87 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.63 -1.91 34.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.088 -0.505 . . . . 71.23 110.88 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.425 ' C ' HD13 ' A' ' 138' ' ' LEU . 0.8 OUTLIER -179.31 172.23 1.22 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 71.43 110.884 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.411 ' O ' HG23 ' A' ' 153' ' ' VAL . 0.7 OUTLIER -75.24 -28.18 59.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 65.35 110.925 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.0 ttt -58.03 -57.21 13.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 72.25 110.843 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -65.69 -37.31 86.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 73.44 110.944 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.509 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.4 OUTLIER -55.43 -46.91 76.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 63.32 110.949 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.434 HG13 ' CD1' ' A' ' 167' ' ' LEU . 69.3 t -64.6 -39.47 85.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 75.44 111.152 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -54.83 -38.72 67.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.103 -0.498 . . . . 73.3 110.949 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.31 -45.43 63.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 74.13 110.887 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.426 ' CD1' HD13 ' A' ' 163' ' ' LEU . 31.9 m-85 -67.22 -21.98 65.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 75.45 110.935 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.424 HG23 ' O ' ' A' ' 167' ' ' LEU . 58.7 m -84.15 -29.95 26.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 73.33 111.139 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 86.4 m -78.13 -27.0 48.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.203 -0.453 . . . . 61.52 111.121 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -164.71 155.65 14.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.245 -0.434 . . . . 75.51 110.838 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.532 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -51.35 -58.2 6.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.135 -0.484 . . . . 75.11 111.092 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 52.51 28.97 6.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.277 -0.419 . . . . 72.25 110.873 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 121.89 -2.54 10.88 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.712 -0.756 . . . . 74.42 112.514 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.532 ' O ' ' HB1' ' A' ' 160' ' ' ALA . 9.6 mp -101.62 136.45 41.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.786 0.327 . . . . 72.12 110.969 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . 0.473 ' SG ' HG22 ' A' ' 165' ' ' THR . 19.5 p -54.42 -26.72 32.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.169 -0.469 . . . . 72.14 110.894 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.473 HG22 ' SG ' ' A' ' 164' ' ' CYS . 9.0 t -157.31 125.09 5.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.103 -0.499 . . . . 70.1 111.126 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -51.96 164.99 0.23 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 73.34 110.845 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.501 HD22 ' HB3' ' A' ' 104' ' ' PHE . 11.5 mt -84.58 138.72 32.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 71.4 110.924 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.643 HD12 ' O ' ' A' ' 101' ' ' THR . 27.7 mt -127.22 -51.22 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 75.03 111.106 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -128.58 121.22 21.11 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.533 0.682 . . . . 41.32 110.935 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.84 136.99 34.19 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.633 2.222 . . . . 71.14 112.31 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.41 83.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 74.3 110.88 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 26.9 m -64.64 133.1 30.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 45.41 111.136 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 37.6 mtm . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 72.03 110.822 179.929 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.236 0 CA-C-O 121.423 0.457 . . . . 65.32 112.464 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 169.48 18.83 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 122.704 2.27 . . . . 73.04 112.321 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 47.1 mt -56.5 -39.45 73.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.215 -0.448 . . . . 75.04 110.903 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 102.64 -29.19 13.0 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.797 -0.716 . . . . 61.45 112.487 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 5.3 m -84.37 137.14 33.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.964 0.411 . . . . 74.32 110.859 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 3.6 mttp -141.06 178.91 7.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 73.54 110.911 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.57 93.7 3.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 63.22 110.854 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -171.81 101.69 0.18 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 71.11 110.864 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 1.7 t -128.25 137.42 51.99 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.486 . . . . 72.41 110.868 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 93.2 p -64.32 -172.02 0.06 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 74.12 110.91 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.519 HD22 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER -162.95 106.4 1.06 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 75.03 110.876 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -110.25 88.83 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 63.43 110.837 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -72.61 146.9 46.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.111 -0.495 . . . . 75.25 110.904 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -140.82 129.23 22.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.081 -0.509 . . . . 70.51 110.822 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . 0.502 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -92.31 156.21 17.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 55.43 110.856 -179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -59.17 -19.37 44.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.092 -0.504 . . . . 72.11 110.843 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.7 -39.5 88.1 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 74.42 110.867 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -96.2 -20.16 18.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.46 . . . . 71.43 111.017 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.476 ' HB2' HD11 ' B' ' 305' ' ' LEU . 41.9 m-20 -147.34 77.77 10.51 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.596 0.712 . . . . 72.31 110.888 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -6.37 18.41 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.716 2.277 . . . . 71.24 112.349 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.2 t -93.79 27.45 2.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.249 -0.432 . . . . 65.04 111.167 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.476 HD11 ' HB2' ' B' ' 302' ' ' ASP . 42.1 mt -100.56 136.79 39.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 75.34 110.979 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.621 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -106.45 173.76 6.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 62.34 111.083 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -49.92 -37.45 31.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 62.23 110.89 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -60.87 -50.68 72.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 75.11 110.877 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.621 ' HG2' HG22 ' B' ' 306' ' ' THR . 16.6 mm-40 -66.21 -52.04 51.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 71.34 110.907 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.625 HD12 ' CG ' ' A' ' 111' ' ' ASN . 44.7 mm -56.04 -53.5 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 73.44 111.092 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 20.1 m -64.18 -19.05 65.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 73.44 110.832 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.28 3.79 26.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.101 -0.5 . . . . 35.05 111.134 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -114.37 14.03 17.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 72.4 110.818 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.429 ' HE2' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 23.1 t -98.2 -31.63 11.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.111 -1.404 . . . . 72.11 110.88 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 64.34 155.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 70.42 110.866 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.564 HG21 ' HA ' ' A' ' 141' ' ' ASP . 4.3 m -51.74 120.54 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 62.21 111.145 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -135.43 74.66 1.52 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 75.4 110.955 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.2 mtmp? -58.31 160.43 9.45 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.596 0.712 . . . . 63.34 110.922 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 113.51 3.39 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.675 2.25 . . . . 74.4 112.374 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 CA-C-O 119.15 -0.806 . . . . 74.42 112.565 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 CA-C-O 121.44 0.467 . . . . 54.32 112.451 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -46.11 1.35 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.68 2.253 . . . . 72.2 112.385 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -135.69 29.1 3.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.211 -0.45 . . . . 72.11 110.937 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 154.88 -128.96 2.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.733 -0.746 . . . . 71.33 112.515 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 66.6 m -137.42 55.0 1.82 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.884 0.374 . . . . 73.14 110.878 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.35 74.42 80.98 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.57 0.7 . . . . 73.23 110.869 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.68 -25.77 28.61 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.719 2.279 . . . . 51.41 112.285 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 46.9 p-90 -54.44 -27.1 34.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.261 -0.427 . . . . 64.44 110.915 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -86.52 100.83 12.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 73.32 110.924 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -75.81 -39.42 56.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 73.34 110.894 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.28 22.7 45.06 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.787 -0.72 . . . . 53.21 112.495 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.4 pttt 179.01 68.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.717 0.294 . . . . 73.02 110.872 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 mm -133.7 144.21 36.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 74.21 111.138 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.454 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -101.23 177.03 5.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.472 . . . . 73.41 111.176 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.454 ' H ' HG22 ' A' ' 88' ' ' THR . 0.0 OUTLIER -63.76 -43.57 96.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 74.01 110.84 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.44 -32.52 72.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 74.14 110.897 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -75.61 -43.16 49.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.128 -0.487 . . . . 71.41 110.934 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.83 -33.57 64.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 63.42 111.129 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -63.34 -53.29 54.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 61.32 110.883 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.08 -34.92 79.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 73.44 110.849 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 13.5 mt -60.56 -35.78 76.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 73.54 110.974 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.674 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -102.32 43.55 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 64.4 110.861 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.24 -60.04 5.48 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.673 0.749 . . . . 73.13 110.917 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.82 123.17 9.82 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.727 2.284 . . . . 74.5 112.345 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 117.82 5.31 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.63 2.22 . . . . 74.25 112.396 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -154.81 104.79 2.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 71.41 110.916 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.641 ' O ' HD12 ' A' ' 168' ' ' ILE . 33.2 p -57.98 111.92 1.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 33.32 111.165 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.05 -7.2 6.07 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.772 -0.728 . . . . 41.44 112.522 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.02 113.61 25.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.886 0.375 . . . . 63.22 110.899 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 27.0 p90 -125.22 165.2 18.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 75.1 110.853 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.621 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -161.54 137.28 7.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 64.13 110.939 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 89.0 t -110.19 142.88 21.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 74.12 111.132 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.96 148.83 25.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 73.35 110.855 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -52.08 124.21 12.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 73.35 110.916 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.2 m -59.81 117.31 4.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.108 -0.496 . . . . 55.11 110.928 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.59 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.3 m -69.12 -56.42 7.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.482 . . . . 50.22 111.146 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.456 ' H ' ' ND2' ' A' ' 111' ' ' ASN . 0.9 OUTLIER -70.96 -24.0 62.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 75.01 110.899 179.991 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -113.28 93.51 26.72 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.727 0.775 . . . . 74.32 110.94 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 111.07 2.7 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.721 2.28 . . . . 71.33 112.38 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.6 0.14 24.7 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.768 -0.73 . . . . 24.13 112.53 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -125.29 -175.88 3.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.797 0.332 . . . . 73.22 110.867 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -137.38 148.0 45.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 70.51 110.916 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 25.4 m -115.51 141.68 47.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.108 -0.496 . . . . 73.41 111.156 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.412 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.4 OUTLIER -111.79 116.56 30.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 73.2 110.911 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.1 t -100.65 129.16 46.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.911 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.412 ' CG2' HD21 ' A' ' 118' ' ' LEU . 17.3 t -130.03 149.11 33.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 73.31 111.066 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.674 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -101.07 111.03 23.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.15 -0.477 . . . . 61.03 110.852 -179.784 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.47 93.5 4.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 74.22 110.901 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 66.14 30.78 9.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 73.42 110.839 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.6 -14.3 63.29 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.73 -0.748 . . . . 74.22 112.536 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -88.08 147.5 24.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.756 0.312 . . . . 72.22 110.926 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.425 ' O ' HG23 ' A' ' 126' ' ' VAL . 7.0 m -105.51 109.22 27.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 62.43 111.14 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -96.94 113.7 25.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 72.33 110.865 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -91.13 124.65 35.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.102 -0.499 . . . . 74.24 110.815 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.638 ' CZ ' HD13 ' A' ' 163' ' ' LEU . 48.5 m-85 -114.08 116.19 28.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.218 -0.446 . . . . 72.31 110.909 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.48 137.07 46.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.102 -0.499 . . . . 70.45 110.872 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 26.0 mt -119.7 109.62 26.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 74.14 111.113 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -81.3 124.72 29.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.272 -0.422 . . . . 64.33 110.902 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.494 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -111.67 98.29 7.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.307 -0.406 . . . . 72.53 110.937 -179.875 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -132.06 142.57 49.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 72.4 110.897 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.18 35.97 26.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 74.44 111.073 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.38 26.6 16.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 71.4 110.84 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -131.93 139.14 48.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 72.04 110.894 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.494 HD21 ' CE2' ' A' ' 133' ' ' TYR . 3.7 mp -102.42 149.86 23.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.215 -0.448 . . . . 73.3 110.922 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 29.2 t -166.19 140.96 4.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 61.12 110.814 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.508 HG22 HG13 ' B' ' 317' ' ' VAL . 52.2 mt -115.59 -32.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.048 -0.524 . . . . 74.24 111.173 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.526 ' HA ' HG21 ' B' ' 317' ' ' VAL . 38.7 t0 -89.7 1.05 56.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 72.12 110.92 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 60.41 18.18 7.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 71.0 110.795 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -132.29 -38.43 1.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 72.21 110.88 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.4 t -103.06 104.54 16.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 44.34 111.132 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -99.88 144.69 28.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 62.01 110.933 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.531 ' CD1' HD12 ' A' ' 152' ' ' LEU . 54.8 m-85 -118.64 178.42 4.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 74.14 110.924 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -100.19 -16.22 17.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 75.23 110.917 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -164.81 171.65 13.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.111 -0.495 . . . . 71.23 110.874 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.459 ' H ' HD12 ' A' ' 149' ' ' LEU . 0.7 OUTLIER -74.63 -22.37 58.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 64.21 110.949 179.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.2 ttp -63.67 -56.96 11.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 73.43 110.876 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.82 -36.3 83.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.289 -0.414 . . . . 74.32 110.885 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.531 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.68 -47.58 76.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.198 -0.455 . . . . 73.53 110.916 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.478 HG13 ' CD1' ' A' ' 167' ' ' LEU . 70.7 t -65.29 -37.49 80.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.22 -0.445 . . . . 73.13 111.14 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -55.53 -38.76 69.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.134 -0.485 . . . . 64.41 110.926 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -45.29 61.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.174 -0.466 . . . . 75.43 110.891 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.415 ' CD1' HD23 ' A' ' 163' ' ' LEU . 27.9 m-85 -67.5 -22.17 65.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 74.14 110.962 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 63.6 m -84.32 -29.62 26.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.105 -0.498 . . . . 43.01 111.088 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 92.6 m -78.13 -26.94 48.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 75.21 111.15 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.09 160.8 30.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 62.24 110.85 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.81 -58.28 6.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 63.33 111.068 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 6.0 t0 57.12 23.58 8.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.46 . . . . 73.13 110.947 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.29 -0.64 25.2 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.721 -0.752 . . . . 32.42 112.498 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.638 HD13 ' CZ ' ' A' ' 129' ' ' TYR . 4.0 mm? -93.28 140.08 29.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.942 0.401 . . . . 60.44 110.855 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 44.3 t -51.33 -30.37 18.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 52.42 110.871 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.8 t -158.96 127.34 5.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 70.33 111.137 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -51.35 140.59 16.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 71.4 110.868 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.478 ' CD1' HG13 ' A' ' 153' ' ' VAL . 8.6 mt -62.39 139.51 58.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 54.13 110.919 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.641 HD12 ' O ' ' A' ' 101' ' ' THR . 26.6 mt -126.94 -51.3 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.284 -0.416 . . . . 71.21 111.164 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.7 mttm -131.03 123.35 19.83 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.585 0.707 . . . . 73.11 110.951 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 135.43 30.44 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.711 2.274 . . . . 61.53 112.331 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.8 83.78 0.47 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.244 -0.434 . . . . 75.22 110.886 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.7 m -64.32 136.8 25.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.296 -0.411 . . . . 72.12 111.165 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 70.11 110.824 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 CA-C-O 121.432 0.462 . . . . 72.03 112.451 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 168.41 21.56 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 122.666 2.244 . . . . 63.43 112.365 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 4.6 tp -52.27 -43.26 64.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 73.03 110.917 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 111.21 -40.01 2.7 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.674 -0.775 . . . . 55.24 112.469 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 2.1 t -70.53 96.36 1.17 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.907 0.384 . . . . 71.12 110.87 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 5.2 mttm -143.09 155.25 44.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 70.12 110.878 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.9 92.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 64.22 110.851 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 5.2 t80 179.18 108.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 75.42 110.934 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 31.5 t -79.94 109.88 14.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 74.24 110.816 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 80.0 p -77.9 -178.22 5.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.474 . . . . 75.34 110.821 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 1.7 mt -160.81 98.46 1.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.089 -0.505 . . . . 61.41 110.868 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 40.0 t -84.83 88.68 7.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 72.5 110.832 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -76.08 149.61 37.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 74.35 110.972 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.57 129.17 17.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.117 -0.492 . . . . 55.24 110.932 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . 0.59 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -94.13 163.05 13.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.286 -0.416 . . . . 63.22 110.862 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 10.6 mtt180 -63.8 -15.42 58.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 72.31 110.853 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.26 -37.94 84.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 72.42 110.876 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -96.98 -14.96 21.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.107 -0.497 . . . . 65.33 110.794 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.544 ' HB2' HD11 ' B' ' 305' ' ' LEU . 14.9 m-20 -156.39 80.75 3.7 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.577 0.703 . . . . 75.14 110.85 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -6.01 17.6 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.693 2.262 . . . . 65.04 112.341 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.2 t -93.61 27.26 2.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 72.23 111.188 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' B' ' 302' ' ' ASP . 34.7 mt -103.9 136.89 42.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 72.24 110.875 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.579 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.1 t -102.16 170.05 8.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.164 -0.471 . . . . 72.4 111.139 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -49.67 -33.89 16.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 64.22 110.919 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -62.5 -48.44 79.54 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.162 -0.472 . . . . 62.33 110.9 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.579 ' HG2' HG22 ' B' ' 306' ' ' THR . 7.9 mm-40 -65.14 -51.72 59.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.126 -0.488 . . . . 72.22 110.92 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 27.4 mm -58.59 -53.77 42.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 75.15 111.089 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 26.8 t -58.01 -24.3 57.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 75.24 110.84 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -74.55 -5.67 44.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 51.25 111.069 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.68 14.02 19.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.256 -0.429 . . . . 72.2 110.879 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 3.9 t -102.96 -36.13 8.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.115 -1.402 . . . . 62.15 110.795 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.88 152.82 0.05 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 50.32 110.915 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.526 HG21 ' HA ' ' A' ' 141' ' ' ASP . 4.5 m -54.19 122.28 3.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.468 . . . . 71.13 111.096 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -132.95 74.88 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.069 -0.514 . . . . 74.1 110.919 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.93 160.32 2.29 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.603 0.716 . . . . 61.13 110.932 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 112.28 3.03 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.674 2.249 . . . . 62.42 112.31 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.26 0 CA-C-O 119.169 -0.795 . . . . 44.14 112.471 179.959 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 CA-C-O 121.429 0.461 . . . . 75.01 112.554 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -46.87 1.06 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.653 2.235 . . . . 75.11 112.334 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.11 -43.56 14.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 72.43 110.908 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.61 24.46 5.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.702 -0.761 . . . . 32.3 112.479 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -157.49 27.65 0.29 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.886 0.374 . . . . 52.55 110.862 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -168.65 72.68 0.8 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.593 0.711 . . . . 73.41 110.942 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -27.78 26.18 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.675 2.25 . . . . 71.32 112.293 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.473 ' CH2' HG21 ' A' ' 153' ' ' VAL . 47.0 p-90 -54.82 -26.63 36.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 75.24 110.925 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -84.31 102.33 12.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 54.14 110.876 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 -76.39 -40.05 51.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.126 -0.488 . . . . 72.5 110.897 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.3 18.89 37.6 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.744 -0.741 . . . . 64.12 112.472 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -179.96 78.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.737 0.303 . . . . 74.31 110.864 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.5 mm -142.72 144.41 24.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 63.43 111.061 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.46 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -101.32 175.08 5.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.113 -0.494 . . . . 73.5 111.177 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.46 ' H ' HG22 ' A' ' 88' ' ' THR . 6.6 ttt180 -62.19 -42.71 99.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.183 -0.462 . . . . 75.15 110.883 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -68.34 -33.87 75.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.162 -0.472 . . . . 72.24 110.939 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -75.49 -41.78 54.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.098 -0.501 . . . . 74.32 110.922 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.48 -33.48 62.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.482 . . . . 55.12 111.129 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.448 ' OE2' HG21 ' A' ' 126' ' ' VAL . 20.3 mm-40 -63.4 -53.27 54.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.45 . . . . 75.33 110.922 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.18 -35.6 81.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.479 . . . . 74.13 110.832 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 16.7 mt -61.21 -35.82 78.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 55.41 110.892 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.669 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.5 mm? -102.96 43.12 1.1 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.19 -0.459 . . . . 63.33 110.878 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.495 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.18 -59.97 4.63 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.678 0.751 . . . . 72.04 110.907 179.996 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.9 Cg_endo -69.74 123.09 9.77 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.719 2.279 . . . . 65.4 112.323 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 118.21 5.54 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.665 2.243 . . . . 63.23 112.334 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -154.81 100.48 2.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.27 -0.423 . . . . 71.23 110.858 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.665 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.6 OUTLIER -53.46 111.76 0.77 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 74.25 111.146 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.81 -6.28 6.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.79 -0.719 . . . . 63.34 112.504 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -90.28 111.75 23.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.808 0.337 . . . . 73.12 110.916 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 23.8 p90 -124.54 162.06 24.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 73.31 110.89 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.578 HD23 HD21 ' A' ' 96' ' ' LEU . 0.7 OUTLIER -158.37 138.67 12.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 44.34 110.873 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.838 HG22 HD22 ' A' ' 118' ' ' LEU . 79.9 t -110.16 137.73 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 64.22 111.145 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -149.8 143.39 25.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.212 -0.449 . . . . 75.54 110.882 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -50.24 123.78 9.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.447 . . . . 75.53 110.823 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 m -57.56 115.79 2.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.456 . . . . 72.23 110.86 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.617 HG21 ' HB2' ' B' ' 298' ' ' SER . 2.2 m -68.57 -56.39 8.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 61.34 111.133 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.619 ' CG ' HD12 ' B' ' 310' ' ' ILE . 4.3 m-80 -69.28 -26.62 64.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 71.43 110.921 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.407 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 2.7 m-85 -112.28 94.46 26.62 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.632 0.729 . . . . 70.14 110.939 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.5 Cg_endo -69.77 112.26 3.03 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.663 2.242 . . . . 55.45 112.384 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.77 3.29 23.62 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.743 -0.741 . . . . 74.22 112.434 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -131.05 -176.06 3.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.816 0.341 . . . . 65.01 110.907 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -131.67 165.58 23.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 74.31 110.929 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.607 HG23 ' HE2' ' B' ' 314' ' ' PTR . 99.1 m -126.56 141.61 51.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.086 -0.506 . . . . 72.31 111.184 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.838 HD22 HG22 ' A' ' 106' ' ' VAL . 0.0 OUTLIER -109.16 106.32 16.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.279 -0.418 . . . . 75.33 110.885 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.6 m -98.99 118.69 36.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.47 . . . . 60.45 110.911 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.4 t -124.36 150.41 29.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 72.23 111.045 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.669 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -103.95 112.36 25.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.475 . . . . 71.45 110.941 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.6 97.58 5.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.07 -0.514 . . . . 72.33 110.849 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 65.74 27.61 11.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.884 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.75 -13.38 63.92 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.752 -0.737 . . . . 72.23 112.498 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -88.38 140.3 29.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.764 0.316 . . . . 70.45 110.936 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.59 ' O ' HD13 ' B' ' 294' ' ' LEU . 11.2 m -100.47 111.37 29.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 70.2 111.13 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.454 ' OE2' HD11 ' B' ' 294' ' ' LEU . 2.7 mm-40 -99.68 124.84 45.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.89 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 61.1 m-70 -103.39 124.0 47.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 61.45 110.873 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.523 ' HB3' HD13 ' A' ' 140' ' ' ILE . 88.5 m-85 -114.67 100.24 8.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 72.32 110.964 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -55.54 131.76 46.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 74.34 110.834 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.819 HD11 HD23 ' A' ' 118' ' ' LEU . 38.2 mt -110.45 109.63 29.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 72.23 111.133 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.76 129.08 34.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.11 110.924 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.46 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.97 100.71 8.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.271 -0.422 . . . . 63.12 110.974 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -134.68 142.43 46.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.06 -0.518 . . . . 74.43 110.913 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 57.38 36.13 26.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 63.41 111.058 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.7 t 61.04 27.46 17.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 64.3 110.858 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 2.7 mtmm -133.21 145.34 50.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.136 -0.484 . . . . 75.41 110.82 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.46 HD21 ' CE2' ' A' ' 133' ' ' TYR . 1.6 mp -106.22 150.8 25.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 71.02 110.909 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.9 t -169.62 140.8 2.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 74.12 110.862 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.526 HD11 HG12 ' A' ' 131' ' ' ILE . 59.7 mt -115.51 -26.19 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 61.13 111.175 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.689 ' HB3' HG21 ' B' ' 317' ' ' VAL . 5.9 p30 -96.67 -2.48 44.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.121 -0.49 . . . . 53.52 110.884 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 61.94 16.75 8.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 63.02 110.882 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -127.36 -34.07 2.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 72.33 110.894 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.4 t -111.86 104.75 17.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 64.01 111.127 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -98.33 143.44 28.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.165 -0.47 . . . . 75.33 110.931 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.44 ' CD1' HD12 ' A' ' 152' ' ' LEU . 48.4 m-85 -117.51 171.53 7.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.083 -0.508 . . . . 74.11 110.862 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.68 -18.95 24.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.193 -0.458 . . . . 75.53 110.861 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.508 ' OD1' HD12 ' A' ' 149' ' ' LEU . 45.6 t30 -171.24 158.84 5.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 75.2 110.905 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.508 HD12 ' OD1' ' A' ' 148' ' ' ASN . 2.4 mp -51.36 -36.88 45.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.158 -0.474 . . . . 72.14 110.961 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.4 ttp -51.87 -48.87 63.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 74.5 110.939 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -68.99 -41.67 77.51 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.216 -0.447 . . . . 71.45 110.943 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.44 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.5 OUTLIER -56.0 -50.55 70.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 51.4 110.906 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.473 HG21 ' CH2' ' A' ' 82' ' ' TRP . 91.4 t -59.02 -43.67 89.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 72.31 111.141 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.78 -39.51 71.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 72.32 110.896 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.75 -50.74 48.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 71.34 110.842 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.424 ' CD1' HD13 ' A' ' 163' ' ' LEU . 38.2 m-85 -65.46 -19.63 66.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.469 . . . . 74.2 110.934 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.475 ' OG1' HD12 ' A' ' 167' ' ' LEU . 97.3 m -84.24 -28.77 27.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.13 -0.486 . . . . 74.31 111.041 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 27.2 m -81.92 -24.4 35.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.331 -0.395 . . . . 71.33 111.148 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -161.7 162.25 29.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 64.15 110.874 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.46 -58.1 7.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.207 -0.451 . . . . 64.15 111.0 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 60.76 20.5 10.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 75.42 110.911 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 112.3 13.53 11.83 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 14.5 112.483 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.424 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.6 mp -108.75 138.41 45.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.85 0.357 . . . . 75.23 110.936 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 31.6 t -51.66 -31.17 24.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.901 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 7.2 t -153.99 124.17 6.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.141 -0.481 . . . . 62.01 111.15 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -51.88 156.08 1.59 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 65.2 110.845 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.475 HD12 ' OG1' ' A' ' 157' ' ' THR . 7.7 mt -72.51 134.93 45.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.169 -0.469 . . . . 72.03 110.947 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.665 HD12 ' O ' ' A' ' 101' ' ' THR . 24.6 mt -127.03 -51.11 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.191 -0.459 . . . . 73.12 111.179 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -127.55 121.13 22.18 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.534 0.683 . . . . 74.1 110.866 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 135.13 29.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.694 2.263 . . . . 65.4 112.349 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.66 84.04 0.44 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 73.11 110.914 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 22.0 t -64.42 131.42 30.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.182 -0.463 . . . . 72.31 111.099 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 33.3 mtp . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 75.43 110.881 179.91 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 CA-C-O 121.411 0.451 . . . . 32.41 112.493 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 168.12 22.49 Favored 'Trans proline' 0 C--O 1.233 0.241 0 C-N-CA 122.631 2.221 . . . . 74.44 112.331 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 11.5 tp -63.86 -27.9 69.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.254 -0.43 . . . . 72.54 110.953 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 99.7 27.41 7.99 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.702 -0.761 . . . . 62.3 112.522 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 80.5 p -102.97 164.36 11.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.91 0.386 . . . . 52.32 110.873 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.67 109.74 3.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.15 -0.477 . . . . 73.23 110.933 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -156.15 149.75 24.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 74.22 110.901 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -169.62 83.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 74.33 110.958 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 1.1 m -176.59 99.88 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 55.1 110.85 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 1.5 m -139.54 90.3 2.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.086 -0.506 . . . . 61.23 110.859 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.59 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER -163.81 104.63 0.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.888 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 2.2 m -113.59 89.03 2.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.13 -0.486 . . . . 64.21 110.866 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -72.32 148.26 45.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.51 . . . . 75.23 110.896 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.1 mttt -143.12 129.08 19.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.089 -0.505 . . . . 74.53 110.879 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . 0.617 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -92.04 158.77 16.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.232 -0.44 . . . . 72.14 110.781 -179.862 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -59.76 -19.01 47.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 73.43 110.817 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -37.2 86.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.246 -0.434 . . . . 71.4 110.887 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -96.59 -17.6 20.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 74.44 110.872 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -155.05 79.92 4.48 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.583 0.706 . . . . 71.22 110.843 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -5.69 16.79 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.654 2.236 . . . . 62.1 112.353 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.4 t -92.68 27.53 2.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 73.42 111.132 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 23.8 mt -102.01 136.79 41.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.424 . . . . 72.33 110.922 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.642 HG22 ' HG2' ' B' ' 309' ' ' GLU . 12.1 t -105.98 174.84 5.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 74.4 111.151 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -49.6 -37.97 29.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.212 -0.449 . . . . 72.42 110.868 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.61 -51.83 66.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.149 -0.478 . . . . 74.23 110.846 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.642 ' HG2' HG22 ' B' ' 306' ' ' THR . 20.5 mm-40 -63.43 -52.08 63.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 74.05 110.909 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.619 HD12 ' CG ' ' A' ' 111' ' ' ASN . 43.1 mm -56.83 -53.78 37.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 72.12 111.1 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 26.3 t -58.85 -22.44 58.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.441 . . . . 63.24 110.868 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.53 4.13 25.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.13 -0.486 . . . . 74.34 111.065 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -109.51 14.3 23.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.863 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.607 ' HE2' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 1.6 t -98.71 -27.6 13.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 114.071 -1.422 . . . . 72.45 110.903 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 64.74 153.66 0.06 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.049 -0.523 . . . . 70.23 110.822 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.689 HG21 ' HB3' ' A' ' 141' ' ' ASP . 4.6 m -52.56 126.34 8.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.097 -0.501 . . . . 54.13 111.135 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -136.61 77.47 1.65 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 75.42 110.939 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -52.8 160.58 1.4 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.511 0.672 . . . . 73.12 110.95 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 113.52 3.4 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.678 2.252 . . . . 74.44 112.307 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 CA-C-O 119.146 -0.808 . . . . 71.43 112.556 179.948 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.266 0 CA-C-O 121.322 0.401 . . . . 74.25 112.468 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 -171.79 0.51 Allowed 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.603 2.202 . . . . 73.42 112.381 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.6 mp -54.64 -30.25 54.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 70.51 110.894 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 106.17 20.45 9.21 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.738 -0.744 . . . . 63.12 112.445 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 32.2 t -170.28 58.42 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.866 0.365 . . . . 63.34 110.905 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.0 mtt -139.96 74.07 32.11 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.498 0.666 . . . . 64.5 110.843 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 -7.55 21.34 Favored 'Trans proline' 0 N--CA 1.466 -0.113 0 C-N-CA 122.665 2.243 . . . . 62.32 112.402 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.469 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 35.1 p-90 -101.25 -29.41 12.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 74.33 110.897 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -90.3 106.58 18.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.278 -0.419 . . . . 72.51 110.939 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -83.63 -41.81 17.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 75.44 110.839 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 52.14 34.48 39.77 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.703 -0.761 . . . . 55.11 112.477 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.17 34.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.776 0.322 . . . . 64.2 110.864 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.7 mm -102.69 144.2 13.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 55.22 111.153 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.06 157.43 17.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 75.1 111.108 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.3 ppt_? -52.94 -36.95 60.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 74.41 110.896 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.2 -32.08 55.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 75.22 110.886 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -72.88 -35.23 67.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.165 -0.47 . . . . 74.13 110.929 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.99 -34.78 59.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.171 -0.468 . . . . 70.24 111.092 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -63.3 -52.69 60.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 72.24 110.863 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -39.51 94.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 71.43 110.811 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.3 mt -54.99 -39.34 68.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.276 -0.42 . . . . 73.41 110.943 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.639 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -99.01 43.38 1.06 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.904 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.494 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.42 -59.92 5.43 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.711 0.767 . . . . 71.22 110.926 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.69 123.41 10.1 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.719 2.279 . . . . 75.11 112.418 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 117.53 5.13 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.659 2.239 . . . . 64.25 112.379 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -154.75 112.34 3.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.455 . . . . 70.43 110.965 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.667 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.7 OUTLIER -63.92 111.73 2.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.466 . . . . 70.12 111.209 -179.9 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.95 -6.2 6.1 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.713 -0.756 . . . . 42.44 112.463 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.405 HD12 ' O ' ' A' ' 169' ' ' LYS . 2.4 tp -90.94 113.99 26.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.824 0.345 . . . . 72.1 110.922 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.444 ' HB3' HD22 ' A' ' 167' ' ' LEU . 18.9 p90 -125.55 166.09 17.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.141 -0.481 . . . . 62.34 110.863 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.556 HD23 HD21 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -163.93 138.33 5.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.151 -0.477 . . . . 64.42 110.907 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.469 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 90.5 t -110.37 128.22 66.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 42.12 111.141 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 145.13 42.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 71.23 110.821 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.62 127.15 19.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 63.13 110.864 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.8 m -61.82 113.34 2.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 52.33 110.87 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.543 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.8 m -69.31 -55.99 8.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.487 . . . . 52.42 111.083 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.63 ' CG ' HD12 ' B' ' 310' ' ' ILE . 42.4 m-80 -63.57 -28.97 70.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.439 . . . . 73.22 110.888 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.427 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 33.8 m-85 -119.76 96.94 49.76 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.757 0.789 . . . . 64.42 110.94 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.7 Cg_endo -69.77 119.15 6.15 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.672 2.248 . . . . 62.52 112.375 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.73 -12.82 22.76 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.727 . . . . 71.32 112.499 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -114.26 -178.55 3.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.807 0.337 . . . . 75.03 110.85 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -131.05 160.21 35.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 62.32 110.964 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 58.8 m -133.36 131.85 40.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 73.55 111.12 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.445 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.3 OUTLIER -100.98 121.39 41.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 63.54 110.836 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.3 m -105.36 126.18 51.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.109 -0.496 . . . . 72.0 110.918 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.445 ' CG2' HD21 ' A' ' 118' ' ' LEU . 16.1 t -126.0 151.89 32.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.174 -0.466 . . . . 74.43 111.079 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.639 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.47 111.72 24.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 73.34 110.874 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.7 93.27 4.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.143 -0.481 . . . . 63.25 110.839 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 66.19 29.72 9.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 71.32 110.962 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.99 -13.42 63.54 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.715 -0.755 . . . . 40.2 112.525 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.2 ptpt -88.3 139.25 30.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.33 . . . . 72.42 110.884 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.602 ' O ' HD13 ' B' ' 294' ' ' LEU . 94.0 t -99.66 104.69 16.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 71.04 111.169 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -92.81 122.06 34.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 54.51 110.918 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -100.84 124.85 47.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.13 -0.486 . . . . 72.41 110.85 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -111.9 118.69 36.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.22 -0.445 . . . . 63.51 110.937 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -68.16 134.99 51.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 72.2 110.87 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.47 ' CG2' HD23 ' A' ' 138' ' ' LEU . 53.2 mt -117.59 109.59 28.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.476 . . . . 74.02 111.15 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.8 129.18 34.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 73.12 110.894 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.461 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.64 98.99 7.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.19 -0.459 . . . . 72.21 110.89 -179.822 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -130.94 142.44 50.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.116 -0.493 . . . . 73.34 110.908 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.12 36.77 27.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 72.24 111.07 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.26 23.95 14.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 73.11 110.817 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 3.8 mtmt -128.93 140.48 51.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.164 -0.471 . . . . 72.53 110.947 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.47 HD23 ' CG2' ' A' ' 131' ' ' ILE . 2.8 mp -101.73 151.93 21.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 72.32 110.945 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 39.6 t -168.43 142.22 3.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 74.42 110.874 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.443 HG22 HG13 ' B' ' 317' ' ' VAL . 52.6 mt -115.54 -40.83 3.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 72.32 111.125 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.703 ' HB3' HG21 ' B' ' 317' ' ' VAL . 38.1 p-10 -88.0 -1.04 57.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 61.02 110.93 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 59.6 20.04 8.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 65.43 110.877 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -123.23 -35.61 2.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.16 -0.473 . . . . 65.12 110.779 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.454 HG12 ' OD2' ' A' ' 141' ' ' ASP . 2.6 p -119.11 105.02 16.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 71.44 111.056 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -92.92 153.93 18.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.173 -0.467 . . . . 75.45 110.896 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -124.3 174.23 7.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 73.14 110.936 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.76 -17.91 21.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.01 110.849 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -171.82 158.85 5.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.478 . . . . 63.02 110.899 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.86 -36.02 46.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 64.43 110.9 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 2.6 ttt -53.03 -49.55 66.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 73.34 110.946 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -67.84 -39.69 83.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 71.23 110.948 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.9 -51.63 66.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 70.23 110.928 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.569 HG13 HD12 ' A' ' 167' ' ' LEU . 98.8 t -59.72 -42.85 90.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.23 111.078 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -54.39 -37.77 65.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 63.31 110.831 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -50.42 28.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 63.24 110.813 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.559 ' CD1' HD13 ' A' ' 163' ' ' LEU . 48.6 m-85 -66.49 -14.6 62.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 75.32 110.895 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 81.7 m -88.73 -32.35 17.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 70.23 111.119 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.9 m -80.27 -22.55 41.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 62.13 111.19 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -161.89 161.96 29.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 73.43 110.892 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.94 -58.07 6.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 73.12 111.124 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.87 18.45 10.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.468 . . . . 74.21 110.836 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.57 3.59 27.05 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.701 -0.761 . . . . 44.55 112.484 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.559 HD13 ' CD1' ' A' ' 156' ' ' TYR . 7.2 mp -95.61 138.63 33.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.85 0.357 . . . . 71.2 110.986 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 41.0 t -51.52 -29.87 18.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 73.53 110.948 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.7 t -156.17 122.76 5.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 74.4 111.101 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -51.28 147.36 5.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 63.24 110.898 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.569 HD12 HG13 ' A' ' 153' ' ' VAL . 6.8 mt -65.78 133.86 51.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 73.52 110.987 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.667 HD12 ' O ' ' A' ' 101' ' ' THR . 28.1 mt -127.12 -51.32 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 74.14 111.153 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . 0.405 ' O ' HD12 ' A' ' 103' ' ' LEU . 6.0 mtpm? -126.67 118.38 22.71 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.481 0.657 . . . . 75.23 110.961 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.68 139.95 41.79 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.689 2.26 . . . . 51.5 112.36 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . 0.404 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -70.07 82.94 0.51 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.243 -0.435 . . . . 73.31 110.912 179.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 15.8 m -64.81 125.99 22.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.278 -0.419 . . . . 71.32 111.171 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 30.3 mtp . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 72.54 110.847 179.969 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 CA-C-O 121.45 0.472 . . . . 71.32 112.475 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 164.47 34.44 Favored 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.729 2.286 . . . . 73.44 112.304 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 7.2 mp -54.99 -39.19 68.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.193 -0.458 . . . . 61.13 110.931 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 109.89 19.91 7.91 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.706 -0.759 . . . . 54.42 112.432 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -161.68 152.37 17.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.901 0.381 . . . . 75.21 110.829 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.46 136.93 10.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.129 -0.487 . . . . 75.24 110.896 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.4 93.05 0.27 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 61.2 110.83 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -172.55 105.34 0.16 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.22 -0.446 . . . . 71.44 110.92 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 47.6 t -109.47 113.68 26.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 70.25 110.781 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 56.8 p -59.72 -174.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.022 -0.535 . . . . 53.42 110.824 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.602 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.3 OUTLIER -163.96 113.3 1.23 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.099 -0.5 . . . . 75.3 110.868 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 12.2 t -119.99 88.33 2.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 75.35 110.912 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -75.09 149.25 39.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 64.05 110.881 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -142.98 129.14 19.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.097 -0.501 . . . . 65.31 110.911 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . 0.543 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -91.42 163.62 14.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 63.12 110.851 -179.844 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -64.06 -14.98 58.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.074 -0.512 . . . . 74.0 110.86 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -37.34 79.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 53.12 110.86 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -98.11 -18.21 18.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.103 -0.499 . . . . 74.1 110.893 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.432 ' HB2' HD11 ' B' ' 305' ' ' LEU . 8.0 m-20 -151.47 78.06 7.1 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.65 0.738 . . . . 75.24 110.923 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -5.95 17.39 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.681 2.254 . . . . 73.32 112.382 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.6 t -93.32 27.5 2.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 74.14 111.113 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' B' ' 302' ' ' ASP . 31.3 mt -101.45 136.82 40.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 54.1 110.894 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.645 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -106.03 173.55 6.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 55.13 111.09 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -49.4 -37.77 26.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 71.11 110.873 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -60.91 -53.02 62.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 53.23 110.912 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.645 ' HG2' HG22 ' B' ' 306' ' ' THR . 15.0 mm-40 -62.93 -52.44 63.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.195 -0.457 . . . . 74.54 110.91 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.63 HD12 ' CG ' ' A' ' 111' ' ' ASN . 41.9 mm -55.9 -53.92 32.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.11 -0.496 . . . . 75.4 111.154 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 60.5 p -58.71 -21.8 55.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 75.42 110.86 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.23 4.09 24.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.159 -0.473 . . . . 55.21 111.101 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . 0.573 ' HE2' HD13 ' B' ' 310' ' ' ILE . 1.9 mtm -115.0 14.14 17.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.458 . . . . 53.44 110.935 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.584 ' HE1' HG22 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 11.6 t -109.46 -38.49 5.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.14 -1.391 . . . . 64.32 110.779 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.77 132.67 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.465 . . . . 60.41 110.806 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.703 HG21 ' HB3' ' A' ' 141' ' ' ASP . 20.7 m -52.47 125.64 6.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.042 -0.527 . . . . 71.43 111.13 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -130.59 76.34 1.72 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 75.31 110.841 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -57.85 160.62 7.92 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.601 0.715 . . . . 74.3 110.859 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 112.22 3.02 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.669 2.246 . . . . 75.1 112.342 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 CA-C-O 119.095 -0.836 . . . . 74.12 112.409 -179.962 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 CA-C-O 121.396 0.442 . . . . 73.14 112.462 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -19.9 35.59 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.664 2.243 . . . . 60.32 112.322 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.12 -22.91 8.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 74.22 110.909 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -51.99 -36.82 43.77 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.701 -0.761 . . . . 71.32 112.525 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -130.0 44.99 2.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.845 0.355 . . . . 75.42 110.781 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 28.3 mtt -151.76 74.22 7.88 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.623 0.725 . . . . 73.34 110.948 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -7.62 21.52 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.724 2.283 . . . . 73.05 112.347 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.476 ' CH2' HG21 ' A' ' 153' ' ' VAL . 42.9 p-90 -99.98 -29.81 12.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.221 -0.445 . . . . 74.42 110.832 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -85.78 99.3 11.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.261 -0.427 . . . . 65.23 110.895 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.88 -37.0 59.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 62.42 110.796 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.61 19.61 35.52 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.722 -0.752 . . . . 43.52 112.509 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.65 80.51 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.7 0.286 . . . . 53.55 110.82 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.589 HG23 ' HB3' ' A' ' 91' ' ' GLN . 27.2 mm -145.12 144.99 21.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.277 -0.419 . . . . 61.41 111.175 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.3 p -100.38 177.09 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.214 -0.448 . . . . 64.3 111.216 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 64.1 ttt-85 -63.75 -41.22 98.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 62.15 110.858 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.36 -36.79 83.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.435 . . . . 74.45 110.914 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.589 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -75.25 -39.8 59.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 71.32 110.969 -179.938 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.46 -33.94 65.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 71.41 111.074 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -65.0 -53.34 47.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.445 . . . . 72.24 110.887 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.86 -35.55 81.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.46 . . . . 74.23 110.891 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.55 -35.43 77.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 52.03 110.926 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.638 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -105.48 43.38 1.13 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.11 110.951 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.488 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.98 -60.21 4.56 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.748 0.785 . . . . 62.54 110.933 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.3 Cg_endo -69.79 123.64 10.29 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.663 2.242 . . . . 73.23 112.343 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.8 117.57 5.16 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.717 2.278 . . . . 71.24 112.392 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -154.72 110.3 3.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.889 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.664 ' O ' HD12 ' A' ' 168' ' ' ILE . 1.1 p -61.98 111.88 2.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 75.02 111.114 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.68 -6.88 6.2 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 73.13 112.491 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.439 HD21 ' HE3' ' A' ' 171' ' ' LYS . 2.7 tp -90.72 111.79 23.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.855 0.36 . . . . 74.1 110.859 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.418 ' HB3' HD22 ' A' ' 167' ' ' LEU . 18.9 p90 -123.12 167.63 13.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 73.42 110.879 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.576 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -163.39 137.13 5.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.114 -0.494 . . . . 73.21 110.883 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.44 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 90.1 t -110.4 135.16 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 74.35 111.143 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -149.1 140.51 23.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.178 -0.465 . . . . 53.35 110.888 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -50.96 124.01 10.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.437 . . . . 61.2 110.857 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.7 t -55.44 119.38 5.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 50.13 110.866 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 94.1 m -70.15 -56.15 7.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 71.12 111.111 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -63.42 -42.64 98.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.255 -0.43 . . . . 70.14 110.871 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -106.01 96.08 12.24 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.621 0.724 . . . . 74.42 110.923 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 122.21 8.88 Favored 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 122.647 2.232 . . . . 74.23 112.342 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.75 -9.64 23.57 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.757 -0.735 . . . . 74.23 112.479 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -118.64 176.89 5.05 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.768 0.318 . . . . 62.25 110.925 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -124.13 158.68 31.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.285 -0.416 . . . . 72.31 110.93 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.693 HG23 ' HE2' ' B' ' 314' ' ' PTR . 27.5 m -132.19 121.67 24.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 72.31 111.194 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.443 HD23 ' CD1' ' A' ' 129' ' ' TYR . 0.4 OUTLIER -95.01 116.84 29.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 73.24 110.916 179.974 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 1.8 t -102.33 125.53 49.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.278 -0.419 . . . . 53.04 110.811 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 15.1 t -125.68 151.39 31.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 63.12 111.141 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.638 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.06 112.07 24.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.476 . . . . 75.53 110.843 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.55 94.36 4.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 75.23 110.904 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 66.56 29.15 9.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 73.33 110.925 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 98.0 -14.3 62.79 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.7 -0.762 . . . . 72.12 112.523 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.88 139.65 30.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.806 0.336 . . . . 64.41 110.973 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.447 ' O ' HG23 ' A' ' 126' ' ' VAL . 6.2 m -98.84 99.68 9.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.289 -0.414 . . . . 73.53 111.157 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -86.67 123.75 32.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 73.24 110.915 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 53.6 m-70 -101.38 127.15 48.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.118 -0.492 . . . . 74.3 110.946 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.443 ' CD1' HD23 ' A' ' 118' ' ' LEU . 69.5 m-85 -113.48 106.23 14.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.181 -0.463 . . . . 71.43 110.933 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -58.26 137.25 57.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 72.13 110.902 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.448 ' CG2' HD23 ' A' ' 138' ' ' LEU . 61.8 mt -117.97 107.31 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 74.15 111.163 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.77 126.68 31.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 73.33 110.874 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -113.88 114.62 26.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.456 . . . . 74.43 110.936 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -149.72 138.37 20.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.137 -0.483 . . . . 72.24 110.922 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 53.66 35.83 22.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 64.41 111.094 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.72 28.81 16.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 63.53 110.863 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -129.36 140.1 51.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 71.41 110.847 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.448 HD23 ' CG2' ' A' ' 131' ' ' ILE . 1.8 mp -105.51 147.22 28.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.132 -0.485 . . . . 61.4 110.883 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 28.0 t -164.45 139.17 5.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 73.02 110.874 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.43 HG22 HG13 ' B' ' 317' ' ' VAL . 46.2 mt -115.53 -40.85 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.145 -0.48 . . . . 60.11 111.152 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.483 ' HA ' HG21 ' B' ' 317' ' ' VAL . 20.7 p30 -83.86 -7.02 59.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 71.14 110.882 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 61.79 16.12 7.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.187 -0.46 . . . . 73.4 110.889 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -123.23 -11.29 7.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 71.03 110.916 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -143.07 104.36 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.156 -0.474 . . . . 63.34 111.118 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -92.58 144.68 25.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.23 110.885 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -115.17 175.37 5.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.096 -0.502 . . . . 74.54 110.868 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.34 -13.92 18.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 45.21 110.932 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -168.7 171.84 8.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 65.11 110.883 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 mp -73.87 -24.02 59.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 70.32 110.908 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 2.0 tmm? -59.6 -56.89 16.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 74.51 110.889 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -68.08 -36.5 79.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.287 -0.415 . . . . 61.32 110.885 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.47 -52.98 61.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.245 -0.434 . . . . 72.34 110.968 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.476 HG21 ' CH2' ' A' ' 82' ' ' TRP . 56.9 t -62.61 -36.22 74.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.116 -0.493 . . . . 73.33 111.133 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -55.33 -39.49 70.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 74.45 110.883 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -71.89 -50.3 30.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 74.25 110.838 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -62.71 -22.32 66.43 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.136 -0.484 . . . . 74.04 110.95 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.654 ' OG1' HD12 ' A' ' 167' ' ' LEU . 89.1 m -86.38 -27.13 24.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.095 -0.502 . . . . 72.13 111.166 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 90.0 m -79.4 -23.66 43.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 74.4 111.095 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.76 165.45 23.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.249 -0.432 . . . . 64.24 110.892 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.27 -58.3 6.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.187 -0.46 . . . . 40.42 111.101 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 58.65 21.38 8.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.119 -0.491 . . . . 70.34 110.814 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 106.75 16.69 13.39 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.692 -0.766 . . . . 73.43 112.465 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 8.6 mp -107.3 140.31 40.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.833 0.349 . . . . 64.32 110.933 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 48.6 t -51.78 -29.89 20.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.465 . . . . 73.2 110.912 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.7 t -159.4 123.58 3.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 75.54 111.176 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.96 146.16 6.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 62.22 110.884 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.654 HD12 ' OG1' ' A' ' 157' ' ' THR . 7.3 mt -65.0 136.68 57.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 75.22 110.903 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.664 HD12 ' O ' ' A' ' 101' ' ' THR . 28.1 mt -127.06 -51.23 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.273 -0.421 . . . . 72.24 111.167 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.21 119.63 19.73 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.659 0.742 . . . . 72.34 110.851 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 140.76 43.39 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.73 2.287 . . . . 71.23 112.361 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . 0.439 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -70.67 82.72 0.61 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 72.53 110.891 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 26.8 m -64.89 129.03 28.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.411 . . . . 64.2 111.079 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.9 ptm . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 64.51 110.853 179.912 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 CA-C-O 121.484 0.491 . . . . 75.24 112.53 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 129.45 17.69 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.707 2.271 . . . . 74.51 112.366 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 70.74 -70.63 0.15 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.325 -0.398 . . . . 75.13 110.895 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 92.87 19.65 36.27 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.754 -0.736 . . . . 64.43 112.494 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.76 142.52 32.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.945 0.403 . . . . 72.32 110.843 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -150.3 160.45 43.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.503 . . . . 72.12 110.907 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.02 146.67 10.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 72.32 110.888 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -148.14 85.42 1.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 71.2 110.88 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 6.0 p -179.36 70.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 72.41 110.841 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 49.2 m -115.22 79.44 1.28 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.107 -0.497 . . . . 64.24 110.843 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -143.23 117.83 9.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 72.21 110.911 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 9.4 t -123.03 88.07 2.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 74.21 110.795 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -76.19 149.06 37.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.107 -0.497 . . . . 73.55 110.937 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -158.2 129.73 6.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 70.42 110.884 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.13 175.83 5.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.245 -0.434 . . . . 44.32 110.873 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 26.5 mtt180 -64.48 -15.67 61.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.134 -0.485 . . . . 73.01 110.864 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -41.83 99.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.228 -0.442 . . . . 71.13 110.906 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -104.2 -10.38 17.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.099 -0.5 . . . . 52.15 110.937 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.529 ' HB2' HD11 ' B' ' 305' ' ' LEU . 7.1 m-20 -158.15 78.6 3.33 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.598 0.713 . . . . 75.51 110.872 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -6.12 17.81 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.697 2.264 . . . . 61.12 112.344 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.9 t -93.18 27.18 2.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.246 -0.434 . . . . 73.25 111.102 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.529 HD11 ' HB2' ' B' ' 302' ' ' ASP . 31.2 mt -105.1 137.97 42.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.436 . . . . 72.13 110.894 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.605 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.5 t -103.66 173.46 6.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.224 -0.444 . . . . 40.32 111.209 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -50.33 -32.83 18.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 73.42 110.918 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . 0.462 ' H ' HG23 ' B' ' 306' ' ' THR . 0.1 OUTLIER -65.83 -47.64 74.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.096 -0.502 . . . . 64.12 110.855 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.605 ' HG2' HG22 ' B' ' 306' ' ' THR . 20.5 mm-40 -67.42 -52.35 40.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 75.13 110.904 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . . . . . . . . . 46.0 mm -55.94 -46.79 80.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 70.23 111.152 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 27.9 p -72.06 -17.03 62.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.855 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.39 2.42 32.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 61.43 111.17 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -115.12 14.21 16.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 61.43 110.902 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.693 ' HE2' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -97.95 -34.52 10.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.083 -1.417 . . . . 74.12 110.849 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 65.15 151.05 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.144 -0.48 . . . . 72.42 110.874 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.483 HG21 ' HA ' ' A' ' 141' ' ' ASP . 6.7 m -51.47 122.58 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.46 . . . . 73.31 111.132 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -135.26 76.7 1.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 75.22 110.927 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -55.22 160.33 3.47 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.618 0.723 . . . . 73.21 110.877 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 113.1 3.26 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.593 2.196 . . . . 63.15 112.409 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 CA-C-O 119.123 -0.821 . . . . 53.14 112.518 -179.989 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 CA-C-O 121.408 0.449 . . . . 74.33 112.532 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 -45.38 1.64 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.613 2.208 . . . . 64.24 112.414 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -105.62 -26.84 11.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.208 -0.451 . . . . 73.13 110.993 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 137.33 -71.7 0.46 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.752 -0.737 . . . . 75.13 112.522 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 19.3 m -140.16 61.19 1.53 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.919 0.39 . . . . 72.33 110.872 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 mtt -130.42 74.08 80.62 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.593 0.711 . . . . 73.4 110.901 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 -7.86 22.14 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.702 2.268 . . . . 54.01 112.378 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.564 ' CH2' HD12 ' A' ' 149' ' ' LEU . 46.2 p-90 -101.94 -29.37 11.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 74.03 110.898 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -85.59 99.56 11.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 75.13 110.818 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -75.88 -38.77 57.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 62.4 110.831 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.34 20.66 45.25 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.736 -0.745 . . . . 41.33 112.502 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 179.38 66.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 64.3 110.932 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.555 HG21 ' HB2' ' A' ' 92' ' ' ALA . 7.3 mm -129.58 144.74 37.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.443 . . . . 75.41 111.106 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.447 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -95.33 176.98 5.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.19 -0.459 . . . . 73.21 111.144 179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.447 ' H ' HG22 ' A' ' 88' ' ' THR . 0.0 OUTLIER -66.67 -38.25 86.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 72.24 110.858 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.87 -33.63 62.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.445 . . . . 61.21 110.847 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -73.54 -41.33 63.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.24 110.832 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.555 ' HB2' HG21 ' A' ' 87' ' ' ILE . . . -75.32 -33.65 61.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 74.52 111.097 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -62.16 -53.47 54.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 73.23 110.863 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -38.49 91.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.12 110.892 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 92' ' ' ALA . 15.5 mt -54.99 -38.91 68.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.181 -0.463 . . . . 75.51 110.905 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.594 HD12 ' CB ' ' A' ' 121' ' ' SER . 1.6 mm? -101.26 43.7 1.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 72.31 110.892 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.5 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -66.89 -59.46 7.72 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.656 0.741 . . . . 72.44 110.978 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.81 123.11 9.76 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.697 2.264 . . . . 74.5 112.312 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 119.1 6.1 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.683 2.255 . . . . 61.44 112.34 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -155.09 108.99 2.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 74.31 110.95 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.663 ' O ' HD12 ' A' ' 168' ' ' ILE . 1.0 OUTLIER -60.92 117.17 5.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 62.4 111.153 -179.902 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 123.83 -6.49 8.96 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.734 -0.746 . . . . 53.31 112.493 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 tp -91.2 116.02 28.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 64.24 110.869 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.601 ' HB3' HD22 ' A' ' 167' ' ' LEU . 14.9 p90 -128.25 163.38 24.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 72.21 110.866 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.556 HD23 HD21 ' A' ' 96' ' ' LEU . 1.1 pp -161.18 134.83 6.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.494 . . . . 74.23 110.886 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 87.0 t -109.65 136.03 46.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 73.12 111.133 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -147.13 144.24 28.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 64.52 110.874 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -51.66 124.19 11.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.471 . . . . 73.15 110.88 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.7 m -57.22 116.05 3.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 63.03 110.806 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 78.8 m -69.31 -56.39 7.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.103 -0.499 . . . . 71.13 111.115 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.433 ' OD1' HG21 ' B' ' 310' ' ' ILE . 21.3 p30 -71.7 -26.57 62.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.238 -0.437 . . . . 72.23 110.866 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.71 90.24 7.23 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.768 0.794 . . . . 72.01 110.886 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 112.32 3.05 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.671 2.247 . . . . 61.3 112.336 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.58 6.0 21.95 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.718 -0.753 . . . . 54.41 112.502 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -136.16 178.76 6.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.829 0.347 . . . . 71.25 110.871 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 99.2 m-85 -128.58 160.48 32.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.446 . . . . 75.13 110.948 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 93.4 m -131.68 140.27 49.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.09 -0.504 . . . . 52.44 111.137 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.403 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.3 OUTLIER -112.13 120.59 42.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 72.53 110.859 179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 3.8 t -103.36 126.19 50.39 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.144 -0.48 . . . . 75.05 110.923 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.403 ' CG2' HD21 ' A' ' 118' ' ' LEU . 19.3 t -128.06 146.3 33.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 72.54 111.107 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.594 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -99.41 110.43 22.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 34.42 110.896 -179.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.49 94.05 4.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.135 -0.484 . . . . 72.22 110.913 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 66.92 28.81 8.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.223 -0.444 . . . . 74.22 110.828 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.75 -16.22 60.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.732 -0.747 . . . . 44.13 112.503 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -87.99 139.78 30.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.839 0.352 . . . . 71.23 110.888 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.437 ' O ' HG23 ' A' ' 126' ' ' VAL . 11.4 m -98.06 110.3 25.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 74.02 111.117 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -97.03 113.62 25.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 72.52 110.828 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -90.77 124.76 35.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.131 -0.486 . . . . 64.22 110.848 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.615 ' CE1' HD13 ' A' ' 163' ' ' LEU . 58.3 m-85 -115.54 108.93 17.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.151 -0.477 . . . . 71.22 110.935 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.02 142.54 58.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.14 -0.482 . . . . 73.55 110.834 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.454 HG22 HD23 ' A' ' 138' ' ' LEU . 30.8 mt -122.59 111.66 31.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.215 -0.448 . . . . 64.51 111.152 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -84.1 130.11 34.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 72.23 110.833 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.459 ' CE2' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.32 100.75 8.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 73.25 110.92 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -134.4 142.57 47.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 74.15 110.852 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.9 37.69 28.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.129 -0.487 . . . . 62.01 111.08 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.73 31.59 21.33 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.983 0.421 . . . . 71.13 110.89 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 4.0 mtmm -138.41 143.34 39.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.099 -0.5 . . . . 74.51 110.83 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.608 HD22 HD22 ' A' ' 149' ' ' LEU . 1.4 mp -104.25 151.67 23.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.25 110.953 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -169.4 144.99 3.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.238 -0.437 . . . . 72.14 110.839 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.413 HG22 HG13 ' B' ' 317' ' ' VAL . 47.8 mt -115.61 -37.83 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.103 -0.499 . . . . 74.13 111.122 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.499 ' HB3' HG11 ' B' ' 317' ' ' VAL . 9.8 p30 -88.77 -0.3 57.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 72.43 110.896 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 60.93 17.35 7.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.23 -0.441 . . . . 73.42 110.905 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -125.27 -32.48 2.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 71.4 110.864 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -113.65 104.62 17.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 71.51 111.081 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -97.74 143.86 27.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.45 . . . . 74.34 110.97 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -119.06 175.18 5.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.05 -0.523 . . . . 71.31 110.886 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -97.05 -16.38 20.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 74.14 110.912 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -172.49 159.71 4.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 65.53 110.895 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.608 HD22 HD22 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -52.21 -39.19 59.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 71.3 110.978 179.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.8 ttt -51.03 -49.74 59.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 71.34 110.872 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -66.93 -39.85 87.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 64.2 110.941 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 1.1 tt -57.07 -50.69 71.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 44.34 110.912 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.479 HG21 ' CH2' ' A' ' 82' ' ' TRP . 96.8 t -57.95 -44.24 86.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.23 -0.441 . . . . 74.11 111.108 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -53.27 -40.17 64.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 73.11 110.954 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.69 -52.96 17.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.17 -0.468 . . . . 70.43 110.894 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.41 ' CE1' HD23 ' A' ' 163' ' ' LEU . 36.2 m-85 -62.27 -17.48 58.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 71.3 110.893 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.443 HG23 ' O ' ' A' ' 167' ' ' LEU . 80.9 m -85.91 -32.81 21.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 64.33 111.152 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 3.2 m -82.12 -16.3 50.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.193 -0.458 . . . . 75.04 111.154 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -177.38 131.85 0.17 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 74.41 110.872 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.41 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -50.3 -58.45 5.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 65.34 111.077 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 50.86 37.93 18.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.208 -0.451 . . . . 70.03 110.855 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 129.76 0.45 5.67 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.728 -0.748 . . . . 43.41 112.461 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.615 HD13 ' CE1' ' A' ' 129' ' ' TYR . 2.5 mm? -106.73 139.58 40.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.835 0.35 . . . . 45.14 110.975 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 53.7 t -56.79 -21.72 30.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 74.15 110.893 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.8 t -162.2 116.36 1.84 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.143 -0.48 . . . . 71.05 111.119 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.41 138.02 13.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 60.14 110.864 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.601 HD22 ' HB3' ' A' ' 104' ' ' PHE . 8.4 mt -61.34 126.71 28.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.441 . . . . 75.44 110.848 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.663 HD12 ' O ' ' A' ' 101' ' ' THR . 51.3 mt -109.71 -51.49 6.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 75.4 111.112 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . 0.412 ' HE3' HG22 ' A' ' 168' ' ' ILE . 3.8 mtmp? -136.77 139.71 29.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.562 0.696 . . . . 75.14 110.858 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.82 139.46 40.08 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.631 2.221 . . . . 61.22 112.276 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.54 84.3 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 74.12 110.885 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 29.2 m -63.95 131.01 29.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 64.14 111.106 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.5 ptt? . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 64.3 110.923 179.841 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 CA-C-O 121.471 0.484 . . . . 32.23 112.521 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 170.0 17.55 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.677 2.251 . . . . 71.0 112.334 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 42.6 mt -55.34 -45.52 76.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 74.41 110.916 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 104.15 20.52 10.36 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.734 -0.746 . . . . 54.41 112.43 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 67.0 m -127.57 139.35 52.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.885 0.374 . . . . 34.14 110.861 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -158.74 128.76 5.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 74.44 110.886 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -133.9 121.97 22.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 71.24 110.884 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -178.92 133.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 61.42 110.889 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 1.8 m -126.15 85.11 2.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.507 . . . . 65.22 110.856 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 97.5 p -60.25 -171.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.111 -0.495 . . . . 73.01 110.812 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.66 116.72 2.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 63.55 110.889 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 10.3 t -101.71 87.87 3.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 65.34 110.902 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -83.53 119.53 24.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 74.22 110.863 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -120.72 128.52 53.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 75.22 110.939 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.22 172.63 8.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 64.13 110.913 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 51.3 mtt180 -62.52 -16.41 55.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 74.41 110.838 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -37.78 84.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 64.01 110.893 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -104.01 -23.9 13.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 73.52 110.854 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.435 ' HB2' HD11 ' B' ' 305' ' ' LEU . 3.6 m-20 -143.28 78.89 14.57 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.619 0.723 . . . . 73.32 110.857 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -6.16 17.94 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.663 2.242 . . . . 70.21 112.35 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.7 t -93.64 27.58 2.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 64.3 111.119 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.435 HD11 ' HB2' ' B' ' 302' ' ' ASP . 36.8 mt -100.7 147.73 25.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 55.44 110.979 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.611 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.3 t -113.31 173.77 6.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 74.44 111.122 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -48.81 -36.91 17.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.204 -0.453 . . . . 65.54 110.9 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -62.45 -49.89 73.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 72.45 110.9 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.611 ' HG2' HG22 ' B' ' 306' ' ' THR . 18.5 mm-40 -64.12 -48.72 75.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 72.44 110.834 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.433 HG21 ' OD1' ' A' ' 111' ' ' ASN . 42.5 mm -61.94 -35.65 69.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 71.22 111.111 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 10.8 t -77.51 -15.71 59.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 64.34 110.813 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.41 3.62 27.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.135 -0.484 . . . . 72.13 111.082 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . 0.426 ' HE3' ' HA ' ' B' ' 310' ' ' ILE . 0.2 OUTLIER -115.16 14.24 16.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 73.35 110.904 179.924 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 3.5 t -100.28 -30.04 12.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 114.1 -1.409 . . . . 72.34 110.845 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 64.16 156.77 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 74.31 110.818 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.499 HG11 ' HB3' ' A' ' 141' ' ' ASP . 6.0 m -50.86 118.62 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 74.1 111.092 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -136.75 85.34 2.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.163 -0.471 . . . . 72.33 110.866 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -70.77 153.92 94.59 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.519 0.676 . . . . 70.12 110.94 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 114.22 3.64 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.639 2.226 . . . . 64.32 112.353 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 CA-C-O 119.151 -0.805 . . . . 74.33 112.472 179.977 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 CA-C-O 121.39 0.439 . . . . 73.41 112.419 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -49.35 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.674 2.249 . . . . 63.45 112.367 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.63 HD22 ' HE2' ' A' ' 80' ' ' MET . 54.8 mt -109.19 63.06 0.6 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.453 . . . . 72.01 110.84 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.27 56.29 3.66 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.712 -0.756 . . . . 34.1 112.49 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 6.4 p 178.92 33.87 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.924 0.392 . . . . 72.43 110.847 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.63 ' HE2' HD22 ' A' ' 77' ' ' LEU . 0.1 OUTLIER -150.39 81.54 6.62 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.51 0.672 . . . . 61.34 110.887 179.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 -8.16 22.9 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.679 2.253 . . . . 52.52 112.334 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.546 ' CH2' HD12 ' A' ' 149' ' ' LEU . 56.1 p-90 -81.88 -18.79 42.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.218 -0.446 . . . . 74.34 110.911 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.554 ' HD2' HD12 ' A' ' 77' ' ' LEU . 11.8 t80 -97.59 99.28 10.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.44 . . . . 74.51 110.889 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -75.99 -39.48 55.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 73.31 110.871 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 56.84 22.25 40.3 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 74.54 112.508 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.21 69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.773 0.32 . . . . 61.34 110.886 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.403 HG21 ' HB2' ' A' ' 92' ' ' ALA . 11.6 mm -133.12 144.44 36.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 72.4 111.125 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.458 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -98.18 168.89 9.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.15 -0.477 . . . . 73.01 111.105 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.458 ' H ' HG22 ' A' ' 88' ' ' THR . 5.5 ptm180 -58.93 -39.49 81.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.9 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -71.37 -35.62 71.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 74.02 110.963 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -72.93 -40.47 65.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.072 -0.513 . . . . 60.31 110.96 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.403 ' HB2' HG21 ' A' ' 87' ' ' ILE . . . -75.63 -33.74 60.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 73.04 111.138 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -61.67 -53.09 60.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.244 -0.434 . . . . 75.53 110.845 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -38.21 90.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.89 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.1 mt -55.62 -38.07 69.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.479 . . . . 72.23 110.967 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.658 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -100.0 43.27 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.465 . . . . 73.44 110.933 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.498 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.62 -59.87 5.27 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.686 0.755 . . . . 63.13 110.942 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.2 Cg_endo -69.77 123.56 10.22 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.705 2.27 . . . . 72.51 112.332 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 116.87 4.76 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.719 2.28 . . . . 61.43 112.37 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -154.98 109.33 2.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 62.33 110.9 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.688 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.2 OUTLIER -62.09 111.64 2.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 52.44 111.164 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 131.03 -9.21 5.71 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.797 -0.716 . . . . 60.32 112.514 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -87.32 111.65 21.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.873 0.368 . . . . 74.2 110.885 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -123.59 163.63 20.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 74.22 110.908 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.653 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -160.45 135.74 7.96 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.16 -0.473 . . . . 72.44 110.917 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 87.8 t -109.97 137.04 44.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.236 -0.438 . . . . 70.44 111.063 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.7 ptt180 -150.15 144.4 25.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.149 -0.478 . . . . 71.54 110.867 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -54.9 125.71 21.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.484 . . . . 61.42 110.863 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -51.96 116.57 2.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.164 -0.471 . . . . 62.02 110.795 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.5 m -69.95 -29.88 67.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 63.34 111.111 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -102.53 0.35 33.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 73.53 110.881 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.428 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 0.3 OUTLIER -139.7 94.88 9.04 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.657 0.742 . . . . 71.2 110.965 -179.925 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.7 Cg_endo -69.79 113.02 3.24 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.673 2.249 . . . . 75.52 112.354 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.8 -8.87 23.64 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.718 -0.753 . . . . 53.14 112.418 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.09 163.97 15.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.833 0.349 . . . . 75.11 110.87 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -118.32 160.08 22.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 60.33 110.953 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.553 HG23 ' HE1' ' B' ' 314' ' ' PTR . 59.6 m -137.02 127.94 27.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 72.01 111.141 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.58 125.06 46.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 73.42 110.973 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 17.9 t -109.24 124.26 50.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.225 -0.443 . . . . 71.34 110.899 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 12.1 t -123.5 153.39 29.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.471 . . . . 73.35 111.121 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.658 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -104.93 112.49 25.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 44.31 110.879 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.78 94.59 4.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.457 . . . . 54.45 110.926 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 67.16 29.67 7.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 60.5 110.971 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.74 -14.1 63.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.747 -0.739 . . . . 74.1 112.514 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.69 141.05 28.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.858 0.361 . . . . 73.41 110.876 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.666 ' O ' HD13 ' B' ' 294' ' ' LEU . 9.0 m -100.83 111.1 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 74.44 111.149 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -102.23 123.97 46.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 74.1 110.854 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -101.15 132.18 46.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 71.31 110.902 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -116.17 122.73 45.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 61.12 110.921 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.579 ' O ' HG23 ' A' ' 140' ' ' ILE . 14.1 tpt180 -72.17 136.02 46.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 71.21 110.909 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 54.1 mt -117.74 107.08 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 74.04 111.137 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -83.0 128.78 34.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.448 . . . . 71.4 110.896 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.464 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.1 OUTLIER -113.7 103.04 10.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.442 . . . . 73.04 110.917 -179.852 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -140.85 142.64 34.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 73.24 110.847 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.72 39.6 24.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.191 -0.459 . . . . 71.34 111.095 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 56.96 25.15 10.26 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 64.53 110.864 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.8 mtmm -132.0 152.75 50.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 75.54 110.874 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.464 HD21 ' CE2' ' A' ' 133' ' ' TYR . 1.1 mt -115.86 150.49 36.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.434 . . . . 72.5 110.92 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 7.9 t -168.4 145.35 3.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 71.35 110.852 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.579 HG23 ' O ' ' A' ' 130' ' ' ARG . 35.4 mt -115.61 -32.09 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 74.42 111.089 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.482 ' CB ' HG21 ' B' ' 317' ' ' VAL . 36.8 t0 -89.37 1.61 55.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.199 -0.455 . . . . 70.21 110.8 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 60.31 18.18 7.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.445 . . . . 72.55 110.852 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -132.22 -38.81 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.217 -0.447 . . . . 74.13 110.931 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 4.3 t -100.73 104.72 16.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 54.44 111.156 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -100.84 141.11 34.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 74.21 110.946 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.463 ' CD1' HD12 ' A' ' 152' ' ' LEU . 52.0 m-85 -116.66 173.97 6.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 72.34 110.85 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.28 -17.56 22.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.094 -0.503 . . . . 74.24 110.941 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -170.49 158.71 6.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.08 -0.509 . . . . 62.21 110.877 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.546 HD12 ' CH2' ' A' ' 82' ' ' TRP . 0.0 OUTLIER -53.05 -39.42 63.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 63.52 110.925 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.9 ttt -51.29 -47.92 62.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 72.54 110.858 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -68.23 -41.59 81.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.918 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.463 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.8 OUTLIER -55.93 -48.56 75.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 71.44 110.905 -179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.511 HG21 ' CH2' ' A' ' 82' ' ' TRP . 87.9 t -61.81 -40.23 86.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 74.21 111.165 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -56.67 -38.44 72.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.493 . . . . 74.52 110.864 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -51.13 25.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 65.35 110.821 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.464 ' CD1' HD13 ' A' ' 163' ' ' LEU . 36.2 m-85 -64.28 -20.94 66.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 72.43 110.925 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.511 ' OG1' HD12 ' A' ' 167' ' ' LEU . 85.1 m -84.44 -29.48 26.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.118 -0.492 . . . . 71.02 111.122 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 89.0 m -79.44 -24.24 42.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.429 . . . . 64.43 111.167 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -162.54 166.15 25.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 70.41 110.907 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.89 -55.62 16.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 74.53 111.121 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 59.03 21.62 9.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.282 -0.417 . . . . 65.3 110.837 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 107.62 13.66 19.88 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.76 -0.733 . . . . 62.22 112.544 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.464 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.9 mp -108.15 136.25 48.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.882 0.372 . . . . 71.1 110.891 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 26.3 t -51.48 -30.25 19.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 70.05 110.942 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.46 ' HB ' HG22 ' A' ' 101' ' ' THR . 2.9 t -151.65 119.39 6.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 64.02 111.195 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.76 153.24 2.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.256 -0.429 . . . . 75.43 110.953 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.511 HD12 ' OG1' ' A' ' 157' ' ' THR . 6.3 mt -69.44 133.44 47.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.431 . . . . 70.13 110.996 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.688 HD12 ' O ' ' A' ' 101' ' ' THR . 22.4 mt -127.2 -51.23 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 65.31 111.158 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt -126.2 118.92 23.51 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.579 0.704 . . . . 72.43 110.892 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 131.91 22.31 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.712 2.275 . . . . 73.22 112.375 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 83.67 0.53 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.23 -0.441 . . . . 73.3 110.872 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 31.6 m -64.71 144.92 14.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.44 . . . . 75.23 111.162 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 52.41 110.872 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 CA-C-O 121.486 0.492 . . . . 63.32 112.458 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 169.44 18.85 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.711 2.274 . . . . 73.31 112.37 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.86 -42.33 71.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.222 -0.445 . . . . 54.32 110.91 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 78.52 20.76 70.96 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.677 -0.773 . . . . 62.02 112.559 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 2.7 p -84.62 109.14 17.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 65.14 110.807 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 14.5 mttm -153.74 133.98 13.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.128 -0.487 . . . . 64.53 110.958 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -177.88 145.69 0.4 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.254 -0.43 . . . . 73.24 110.827 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -161.55 78.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 64.33 110.915 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -178.98 79.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.143 -0.48 . . . . 75.31 110.869 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.72 111.98 6.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 74.11 110.845 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.666 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER -164.05 108.96 1.01 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.173 -0.467 . . . . 72.45 110.994 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 11.1 p -105.35 88.61 2.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 75.34 110.809 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -81.63 151.13 27.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.141 -0.481 . . . . 75.02 110.973 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . 0.426 ' O ' ' HE1' ' B' ' 313' ' ' MET . 0.0 OUTLIER -148.2 129.22 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 71.31 110.855 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.08 159.28 15.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 70.52 110.831 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 45.4 mtt180 -60.15 -18.48 47.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.094 -0.503 . . . . 71.5 110.873 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.05 -43.41 87.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 74.04 110.863 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.37 -23.18 17.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 70.12 110.918 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.408 ' HB2' HD11 ' B' ' 305' ' ' LEU . 53.6 m-20 -144.52 77.45 13.82 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.624 0.726 . . . . 73.03 110.819 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.84 -5.8 17.12 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.703 2.268 . . . . 44.44 112.3 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.3 t -92.63 27.52 2.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.232 -0.44 . . . . 72.0 111.207 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.408 HD11 ' HB2' ' B' ' 302' ' ' ASP . 24.4 mt -103.92 136.71 43.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 73.25 110.88 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.638 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.1 t -104.5 171.99 7.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 73.02 111.149 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -49.35 -36.82 22.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.272 -0.422 . . . . 74.43 110.885 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.86 -52.08 66.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.197 -0.456 . . . . 73.23 110.932 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.638 ' HG2' HG22 ' B' ' 306' ' ' THR . 18.8 mm-40 -64.15 -52.56 58.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.474 . . . . 71.34 110.932 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.621 HG22 ' HE2' ' B' ' 314' ' ' PTR . 48.0 mm -55.85 -54.52 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 74.51 111.208 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 33.3 t -59.43 -21.38 59.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 73.43 110.872 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.14 3.9 25.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.082 -0.508 . . . . 72.25 111.143 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . 0.473 ' HE2' HD13 ' B' ' 310' ' ' ILE . 1.2 mtm -115.58 14.33 16.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 63.52 110.87 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.621 ' HE2' HG22 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.43 -35.98 6.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.139 -1.391 . . . . 53.24 110.868 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.4 m 66.49 136.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 75.31 110.922 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.482 HG21 ' CB ' ' A' ' 141' ' ' ASP . 5.8 m -51.25 121.97 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 72.45 111.142 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -128.4 78.41 1.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 64.53 110.86 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 23.7 mtmt -60.31 160.45 17.54 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.655 0.74 . . . . 63.41 110.844 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 112.3 3.04 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.628 2.219 . . . . 74.05 112.425 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 CA-C-O 119.143 -0.809 . . . . 52.22 112.488 179.979 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 CA-C-O 121.458 0.477 . . . . 63.02 112.462 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.79 -39.94 5.86 Favored 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 122.653 2.236 . . . . 61.41 112.306 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.76 -29.65 5.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.288 -0.415 . . . . 72.35 110.918 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 158.43 -73.37 0.23 Allowed Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.714 -0.755 . . . . 60.43 112.46 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 18.6 m -132.89 59.58 1.73 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 65.5 110.814 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 32.9 mtt -146.1 68.1 12.43 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.567 0.699 . . . . 55.13 110.867 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -7.89 22.21 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.673 2.249 . . . . 72.21 112.272 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.456 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 38.9 p-90 -101.57 -30.51 11.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.287 -0.415 . . . . 74.24 110.909 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -86.41 99.09 11.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.41 . . . . 74.13 110.886 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -76.56 -40.39 49.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 71.11 110.903 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.83 24.86 54.98 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 75.23 112.506 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.96 66.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.743 0.306 . . . . 74.33 110.899 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 14.2 mm -129.74 144.32 38.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 55.21 111.131 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.465 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -95.49 170.49 9.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 45.41 111.105 179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.465 ' H ' HG22 ' A' ' 88' ' ' THR . 1.9 ppt_? -60.9 -39.45 89.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 73.45 110.82 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -74.05 -33.78 63.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 73.33 110.9 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -70.82 -40.83 72.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 74.14 110.926 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.468 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -75.18 -34.13 61.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 45.04 111.135 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -60.07 -52.98 63.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 62.34 110.861 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.75 -36.35 82.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 75.43 110.929 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 92' ' ' ALA . 11.1 mt -55.01 -38.26 67.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.131 -0.486 . . . . 72.43 110.92 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.69 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.6 mm? -102.03 43.76 1.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 71.34 110.929 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.502 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.54 -59.68 6.67 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.631 0.729 . . . . 71.43 110.897 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.81 123.61 10.25 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.64 2.227 . . . . 75.23 112.373 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 116.82 4.74 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.674 2.249 . . . . 51.44 112.351 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -154.87 115.16 3.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 72.35 110.939 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.685 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.4 OUTLIER -66.6 111.69 3.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.166 -0.47 . . . . 73.52 111.165 -179.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.19 -5.07 6.37 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.705 -0.759 . . . . 74.05 112.44 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.428 HD12 ' O ' ' A' ' 169' ' ' LYS . 2.9 tp -90.6 113.15 25.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.838 0.352 . . . . 72.21 110.894 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.653 ' HB2' HD11 ' A' ' 118' ' ' LEU . 16.6 p90 -124.38 168.42 13.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 73.4 110.875 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.599 HD23 HD21 ' A' ' 96' ' ' LEU . 0.7 OUTLIER -164.03 137.14 5.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 64.32 110.934 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.485 HG11 HD22 ' A' ' 149' ' ' LEU . 89.5 t -110.65 135.73 48.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 72.44 111.164 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -149.3 143.01 25.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 70.31 110.866 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -54.88 124.08 15.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.181 -0.463 . . . . 62.52 110.885 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.2 m -56.37 115.91 2.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.078 -0.51 . . . . 74.02 110.855 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.4 m -68.61 -56.28 8.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 62.11 111.13 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.409 ' ND2' HG23 ' B' ' 310' ' ' ILE . 26.0 p30 -68.19 -19.55 64.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 71.42 110.963 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.429 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 1.3 m-85 -124.75 93.15 46.61 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.673 0.749 . . . . 74.15 110.934 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 54.0 Cg_endo -69.71 119.84 6.72 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.668 2.245 . . . . 72.34 112.409 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.73 -10.45 23.42 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.792 -0.718 . . . . 62.43 112.473 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -119.46 -178.61 3.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.802 0.334 . . . . 71.11 110.838 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -130.59 162.15 29.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 70.43 110.885 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 96.4 m -130.32 125.33 34.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.111 -0.495 . . . . 63.12 111.195 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.653 HD11 ' HB2' ' A' ' 104' ' ' PHE . 30.2 tp -98.57 112.6 24.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.277 -0.419 . . . . 74.35 110.881 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.1 m -101.04 126.35 47.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.197 -0.456 . . . . 72.0 110.877 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.524 HG21 ' CD1' ' A' ' 163' ' ' LEU . 11.7 t -127.55 151.21 34.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 53.54 111.116 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.69 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -100.27 112.62 24.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.172 -0.467 . . . . 70.55 110.845 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.96 94.27 4.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 72.0 110.909 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 65.58 25.52 11.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.03 110.897 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.9 8.85 55.19 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 51.03 112.535 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -110.55 139.09 46.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.768 0.318 . . . . 64.32 110.874 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.607 ' O ' HD13 ' B' ' 294' ' ' LEU . 69.3 t -95.17 101.21 12.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 73.03 111.162 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -90.24 110.23 21.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 73.55 110.88 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -89.03 124.52 34.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 60.2 110.84 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.53 ' HB3' HD13 ' A' ' 140' ' ' ILE . 66.3 m-85 -113.93 104.49 12.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.232 -0.44 . . . . 62.21 110.908 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -53.76 133.66 42.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.08 -0.509 . . . . 70.44 110.845 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 65.2 mt -113.13 106.95 21.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.456 . . . . 63.21 111.153 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.1 ttm -76.69 129.31 36.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 63.22 110.942 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -114.88 115.97 27.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 74.03 110.972 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -149.58 137.03 20.01 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 64.11 110.869 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.46 36.11 24.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 62.52 111.101 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.57 25.41 14.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 73.01 110.813 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -126.24 144.02 50.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 71.31 110.892 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.9 mp -106.5 150.7 25.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.258 -0.428 . . . . 73.42 110.913 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -168.26 134.84 2.0 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.184 -0.462 . . . . 72.51 110.855 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.597 ' CG2' HG13 ' B' ' 317' ' ' VAL . 50.0 mt -110.77 -33.48 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 74.34 111.138 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.789 ' HB3' HG21 ' B' ' 317' ' ' VAL . 3.4 p30 -95.48 9.8 38.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.114 -0.494 . . . . 74.13 110.864 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 6.7 pt-20 45.48 31.29 0.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.54 110.973 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -131.86 -39.47 1.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.079 -0.51 . . . . 70.43 110.86 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.527 HG12 ' OD1' ' A' ' 141' ' ' ASP . 2.7 p -118.52 104.55 16.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 64.43 111.136 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -91.91 149.83 21.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 74.22 110.891 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -120.09 173.76 6.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 64.05 110.887 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -93.84 -18.19 22.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 52.25 110.886 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -172.05 158.7 4.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 64.11 110.888 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.485 HD22 HG11 ' A' ' 106' ' ' VAL . 0.6 OUTLIER -51.19 -36.02 39.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 74.44 110.881 179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.5 ttt -52.47 -51.14 60.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 63.44 110.928 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -65.99 -40.05 90.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 72.15 110.951 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.71 -49.71 72.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.212 -0.449 . . . . 73.21 110.927 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.64 HG13 HD12 ' A' ' 167' ' ' LEU . 96.5 t -59.04 -44.62 91.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 72.14 111.18 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -52.97 -38.99 62.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.102 -0.499 . . . . 70.55 110.837 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -53.43 16.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 62.24 110.882 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.73 ' CE1' HD23 ' A' ' 163' ' ' LEU . 51.4 m-85 -62.65 -17.27 60.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 55.54 110.896 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 99.6 m -85.83 -32.46 21.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 70.12 111.15 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 16.2 m -79.68 -22.49 43.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 74.24 111.17 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -165.88 161.68 17.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 75.4 110.893 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.31 -58.35 6.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 72.52 111.108 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.01 16.6 9.42 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.256 -0.429 . . . . 52.51 110.873 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 115.3 1.45 21.95 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.695 -0.764 . . . . 62.51 112.467 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.73 HD23 ' CE1' ' A' ' 156' ' ' TYR . 0.9 OUTLIER -93.41 140.39 29.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.801 0.334 . . . . 72.01 110.889 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 34.6 t -51.06 -30.56 16.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.201 -0.454 . . . . 73.12 110.848 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.6 t -158.66 125.11 4.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.246 -0.434 . . . . 55.14 111.183 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -50.77 146.22 6.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 74.44 110.857 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.64 HD12 HG13 ' A' ' 153' ' ' VAL . 7.3 mt -65.04 134.78 54.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 74.31 110.899 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.685 HD12 ' O ' ' A' ' 101' ' ' THR . 25.1 mt -127.13 -51.17 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 52.33 111.11 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . 0.428 ' O ' HD12 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -127.77 118.82 21.19 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.556 0.693 . . . . 63.3 110.904 179.838 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 141.96 46.81 Favored 'Trans proline' 0 C--O 1.232 0.215 0 C-N-CA 122.724 2.283 . . . . 64.01 112.375 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . 0.416 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -70.63 82.51 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.237 -0.438 . . . . 50.52 110.923 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 13.5 m -65.0 124.76 20.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 75.1 111.124 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.2 ptm . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 74.22 110.887 179.911 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 CA-C-O 121.43 0.461 . . . . 63.35 112.473 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.86 169.65 18.55 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.673 2.249 . . . . 54.03 112.311 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.11 -44.98 64.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 63.15 110.928 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 103.44 -21.44 39.19 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.711 -0.757 . . . . 72.13 112.519 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.2 115.79 18.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.86 0.362 . . . . 64.2 110.867 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 22.8 mttt -147.68 146.85 29.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 72.42 110.953 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -150.64 101.65 2.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.264 -0.425 . . . . 54.44 110.932 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -175.11 137.24 0.4 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 74.14 110.868 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -174.13 141.35 0.75 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.482 . . . . 30.22 110.898 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 99.7 p -68.96 -171.96 0.35 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.111 -0.495 . . . . 65.31 110.905 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.607 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER -152.22 104.39 2.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 72.42 110.94 179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.2 t -96.65 88.64 4.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.161 -0.472 . . . . 63.35 110.885 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -77.66 147.87 35.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.495 . . . . 73.21 110.904 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -151.39 129.54 11.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 72.24 110.929 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.84 175.0 5.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 62.41 110.843 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 36.4 mtt180 -64.24 -15.5 60.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.094 -0.503 . . . . 70.44 110.842 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.16 -42.75 99.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 75.03 110.836 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -102.43 -10.75 19.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.165 -0.47 . . . . 74.32 110.931 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.525 ' HB2' HD11 ' B' ' 305' ' ' LEU . 10.4 m-20 -156.83 77.62 4.06 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.592 0.71 . . . . 72.42 110.862 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -6.26 18.18 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.712 2.275 . . . . 63.05 112.337 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.8 t -93.31 27.15 2.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 75.34 111.135 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.525 HD11 ' HB2' ' B' ' 302' ' ' ASP . 34.8 mt -103.98 136.84 42.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 74.11 110.947 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.615 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.7 t -103.4 174.24 5.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 42.04 111.13 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -49.87 -34.37 19.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 73.04 110.895 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . 0.443 ' H ' HG23 ' B' ' 306' ' ' THR . 4.0 tp10 -64.95 -48.95 72.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.482 . . . . 71.54 110.921 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.615 ' HG2' HG22 ' B' ' 306' ' ' THR . 21.3 mm-40 -64.89 -52.22 57.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.074 -0.512 . . . . 75.43 110.872 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.409 HG23 ' ND2' ' A' ' 111' ' ' ASN . 43.9 mm -57.17 -53.28 45.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 72.22 111.145 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 46.8 m -63.67 -18.44 63.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 64.52 110.792 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.38 2.99 29.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.097 -0.501 . . . . 62.24 111.168 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.7 mtt -114.01 14.38 18.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 62.42 110.925 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 13.2 p -116.51 -26.61 7.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.127 -1.397 . . . . 73.12 110.903 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 62.86 161.56 0.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.098 -0.501 . . . . 53.42 110.814 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.789 HG21 ' HB3' ' A' ' 141' ' ' ASP . 15.3 m -68.6 134.47 30.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.108 -0.497 . . . . 62.2 111.15 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -132.14 74.38 1.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 73.02 110.91 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 34.1 mttt -67.43 153.72 94.34 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.595 0.712 . . . . 72.05 110.876 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 113.82 3.5 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.659 2.239 . . . . 75.31 112.378 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 CA-C-O 119.122 -0.821 . . . . 43.42 112.47 179.99 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 CA-C-O 121.433 0.463 . . . . 32.02 112.502 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.699 ' HB2' HD23 ' A' ' 77' ' ' LEU . 53.7 Cg_endo -69.75 -39.3 6.69 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.703 2.269 . . . . 72.4 112.34 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.699 HD23 ' HB2' ' A' ' 76' ' ' PRO . 0.1 OUTLIER -151.24 27.18 0.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 75.1 110.862 179.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 159.41 -100.19 0.19 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.718 -0.753 . . . . 61.2 112.458 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 97.3 p -153.28 64.96 0.76 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.89 0.376 . . . . 73.55 110.872 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.89 73.94 78.82 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.599 0.714 . . . . 61.51 110.917 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -7.75 21.85 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.68 2.253 . . . . 74.04 112.325 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.437 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 39.0 p-90 -102.86 -31.01 10.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.271 -0.422 . . . . 75.34 110.892 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -86.44 102.06 13.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.24 110.893 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -76.25 -36.63 58.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.179 -0.464 . . . . 61.31 110.891 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.39 18.75 37.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.736 -0.745 . . . . 40.25 112.554 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.51 78.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.801 0.334 . . . . 64.53 110.872 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.498 HG21 ' HB2' ' A' ' 92' ' ' ALA . 13.4 mm -139.21 144.28 29.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 75.2 111.103 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.449 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -96.11 176.01 6.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.103 -0.499 . . . . 75.52 111.195 179.933 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.449 ' H ' HG22 ' A' ' 88' ' ' THR . 5.5 ppt_? -65.44 -39.12 91.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.224 -0.444 . . . . 74.43 110.908 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -74.61 -33.07 62.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.165 -0.47 . . . . 62.4 110.883 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -71.77 -43.06 66.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 75.01 110.878 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.498 ' HB2' HG21 ' A' ' 87' ' ' ILE . . . -75.04 -33.82 61.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 65.54 111.126 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -60.25 -53.28 59.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 63.33 110.892 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -36.58 83.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.489 . . . . 72.25 110.892 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' A' ' 92' ' ' ALA . 12.0 mt -55.01 -38.18 67.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.188 -0.46 . . . . 45.23 110.88 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.676 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.2 mm? -102.03 43.75 1.05 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.228 -0.442 . . . . 71.01 110.917 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.62 -59.91 6.27 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.679 0.752 . . . . 74.44 110.975 179.933 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.7 Cg_endo -69.83 123.25 9.89 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.631 2.22 . . . . 73.33 112.326 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 117.58 5.17 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.677 2.251 . . . . 71.45 112.331 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -154.81 108.17 2.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.176 -0.465 . . . . 61.11 110.905 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.659 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -60.79 112.79 2.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 74.22 111.19 -179.923 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.09 -6.9 6.39 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.745 -0.741 . . . . 63.44 112.495 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -90.13 115.44 27.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.855 0.36 . . . . 72.14 110.924 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -126.77 164.36 21.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 74.01 110.882 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.587 HD23 HD21 ' A' ' 96' ' ' LEU . 0.7 OUTLIER -161.13 137.93 8.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 72.3 110.879 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.437 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 92.3 t -110.3 140.27 30.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 65.04 111.08 179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -153.15 145.58 24.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 73.11 110.866 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.53 125.02 13.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 72.14 110.895 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.5 m -58.38 113.19 1.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 72.34 110.774 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.58 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.9 m -68.92 -56.27 8.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.48 . . . . 63.24 111.097 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.637 ' CG ' HD12 ' B' ' 310' ' ' ILE . 34.2 m-80 -65.02 -27.88 69.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.27 -0.423 . . . . 63.23 110.917 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -117.64 94.62 46.2 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.675 0.75 . . . . 72.25 110.927 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 118.09 5.48 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.656 2.237 . . . . 64.21 112.338 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.57 -1.32 24.85 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.757 -0.735 . . . . 54.1 112.485 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -129.06 -173.41 2.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.799 0.333 . . . . 70.11 110.872 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -134.52 166.61 22.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.88 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.4 HG23 ' HE1' ' B' ' 314' ' ' PTR . 57.6 m -138.38 141.6 39.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.098 -0.501 . . . . 64.04 111.14 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.591 ' CD2' HD11 ' A' ' 163' ' ' LEU . 0.4 OUTLIER -110.96 118.23 35.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 75.32 110.949 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.5 m -101.59 125.92 48.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.44 . . . . 72.53 110.892 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.412 HG21 HD12 ' A' ' 163' ' ' LEU . 15.4 t -126.1 150.91 31.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 63.44 111.12 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.676 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.99 111.64 24.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.42 110.878 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.73 93.11 3.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.475 . . . . 75.24 110.931 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 66.81 29.8 8.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 74.34 110.936 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.9 -14.0 63.17 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.763 -0.732 . . . . 74.43 112.508 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -88.14 139.29 30.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 71.23 110.919 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.647 ' O ' HD13 ' B' ' 294' ' ' LEU . 95.6 t -100.09 111.27 29.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 74.42 111.138 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.541 ' OE2' HD11 ' B' ' 294' ' ' LEU . 5.0 mm-40 -100.96 124.18 46.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.469 . . . . 61.14 110.928 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -101.6 124.76 47.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.141 -0.481 . . . . 74.41 110.825 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.61 ' CE1' HD13 ' A' ' 163' ' ' LEU . 72.9 m-85 -112.3 112.73 24.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.467 . . . . 71.33 110.968 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -62.2 139.27 58.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 63.51 110.883 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.456 ' CG2' HD23 ' A' ' 138' ' ' LEU . 60.2 mt -119.69 109.61 26.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 72.14 111.104 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.38 123.29 30.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 64.32 110.89 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.481 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -112.4 98.23 7.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 72.44 110.951 -179.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -131.47 142.61 50.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 74.5 110.865 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.65 36.1 26.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 64.31 111.113 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.51 26.44 16.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 60.42 110.872 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -131.34 139.33 49.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 71.3 110.907 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.481 HD21 ' CE2' ' A' ' 133' ' ' TYR . 4.0 mp -102.08 150.46 23.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.465 . . . . 74.31 110.93 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -167.79 138.37 2.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.875 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.561 HG22 HG13 ' B' ' 317' ' ' VAL . 50.3 mt -112.93 -34.87 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.131 -0.486 . . . . 73.13 111.071 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.616 ' HB3' HG21 ' B' ' 317' ' ' VAL . 7.6 p30 -89.14 -1.67 58.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.254 -0.43 . . . . 65.13 110.853 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 61.12 17.49 8.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 73.21 110.805 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -127.21 -33.36 2.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 72.22 110.915 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -113.36 104.86 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 71.43 111.103 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -97.19 145.65 25.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 73.51 111.009 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.448 ' CD1' HD12 ' A' ' 152' ' ' LEU . 53.8 m-85 -118.52 178.1 4.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 74.41 110.806 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.68 -15.63 17.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.112 -0.495 . . . . 74.34 110.912 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -165.48 172.2 12.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.159 -0.473 . . . . 74.24 110.871 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.405 ' H ' HD12 ' A' ' 149' ' ' LEU . 0.6 OUTLIER -74.71 -23.88 58.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 75.11 110.901 179.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -57.19 11.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 65.03 110.866 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -65.08 -35.33 80.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 73.31 110.908 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.448 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.57 -47.57 76.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.43 110.929 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.472 HG13 HD12 ' A' ' 167' ' ' LEU . 75.2 t -64.99 -39.48 85.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 54.23 111.142 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -54.43 -37.83 65.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.109 -0.496 . . . . 74.24 110.958 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.03 -44.84 62.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.107 -0.497 . . . . 72.4 110.88 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.474 ' CE1' HD23 ' A' ' 163' ' ' LEU . 38.3 m-85 -67.96 -22.09 65.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.451 . . . . 75.2 110.898 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.496 HG23 ' O ' ' A' ' 167' ' ' LEU . 55.5 m -84.24 -30.04 26.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 61.53 111.164 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 19.2 m -78.96 -25.83 43.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.213 -0.449 . . . . 62.4 111.118 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.66 161.68 29.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.194 -0.457 . . . . 41.21 110.868 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.1 -58.32 6.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.419 . . . . 43.5 111.103 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 60.2 19.51 8.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.459 . . . . 72.41 110.907 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 114.43 0.76 23.44 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.696 -0.764 . . . . 73.54 112.449 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.61 HD13 ' CE1' ' A' ' 129' ' ' TYR . 3.0 mm? -93.83 139.2 31.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.888 0.375 . . . . 75.41 110.918 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 36.0 t -51.27 -30.29 17.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 74.12 110.822 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 2.1 t -156.42 125.7 6.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 42.02 111.137 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -50.73 142.22 11.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.227 -0.442 . . . . 74.34 110.819 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.496 ' O ' HG23 ' A' ' 157' ' ' THR . 8.6 mt -64.31 134.62 55.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.14 -0.482 . . . . 64.22 110.847 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.659 HD12 ' O ' ' A' ' 101' ' ' THR . 28.8 mt -121.77 -51.25 3.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 71.42 111.112 179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -132.42 126.36 20.19 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.595 0.712 . . . . 74.12 110.887 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.85 140.58 42.69 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.662 2.241 . . . . 64.44 112.343 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.09 83.48 0.52 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.274 -0.421 . . . . 75.35 110.931 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 29.1 m -64.46 129.91 28.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 71.44 111.173 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.4 ptt? . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 52.23 110.899 179.949 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 CA-C-O 121.469 0.483 . . . . 43.52 112.474 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 169.41 18.92 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.599 2.199 . . . . 74.54 112.352 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.54 -47.59 66.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.152 -0.476 . . . . 72.11 110.962 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 95.23 -21.13 45.91 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.733 -0.746 . . . . 44.41 112.511 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 5.6 p -53.44 130.8 36.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.979 0.418 . . . . 73.41 110.834 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -144.01 152.34 40.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.083 -0.508 . . . . 65.23 110.882 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.5 172.58 6.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.225 -0.443 . . . . 73.01 110.872 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -171.01 65.46 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 71.14 110.925 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 35.1 t -174.32 74.86 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.187 -0.461 . . . . 51.43 110.894 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 9.6 t -134.14 103.41 5.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 74.34 110.835 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.647 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.3 OUTLIER -163.96 112.7 1.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 74.22 110.926 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.91 88.5 2.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 70.53 110.801 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -74.63 149.23 40.1 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.153 -0.476 . . . . 75.23 110.92 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . 0.407 ' O ' ' HE1' ' B' ' 313' ' ' MET . 0.4 OUTLIER -144.55 129.09 18.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.106 -0.497 . . . . 75.13 110.904 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . 0.58 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.1 OUTLIER -91.79 157.02 17.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.247 -0.433 . . . . 73.41 110.852 -179.919 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -59.31 -18.94 42.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.093 -0.503 . . . . 74.13 110.869 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -36.65 84.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 72.4 110.85 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -97.7 -24.55 15.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.185 -0.461 . . . . 72.12 110.893 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.428 ' HB2' HD11 ' B' ' 305' ' ' LEU . 9.2 m-20 -144.59 79.21 12.59 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.677 0.751 . . . . 54.2 110.915 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 -5.83 17.19 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.617 2.211 . . . . 61.25 112.326 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.0 t -93.24 27.43 2.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 74.24 111.145 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.428 HD11 ' HB2' ' B' ' 302' ' ' ASP . 29.2 mt -101.31 136.83 40.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.235 -0.439 . . . . 75.15 110.981 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.638 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.2 t -105.95 172.81 6.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.205 -0.452 . . . . 75.14 111.118 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -49.43 -37.34 25.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 63.31 110.924 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -60.75 -52.43 65.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 74.14 110.85 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.638 ' HG2' HG22 ' B' ' 306' ' ' THR . 10.0 mm-40 -63.64 -52.39 60.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.475 . . . . 70.12 110.915 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.637 HD12 ' CG ' ' A' ' 111' ' ' ASN . 43.3 mm -55.83 -53.77 34.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 73.3 111.171 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 7.8 t -58.67 -22.84 58.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 72.11 110.855 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.54 4.28 25.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.109 -0.496 . . . . 64.42 111.054 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . 0.626 ' HE2' HD13 ' B' ' 310' ' ' ILE . 1.4 mtm -113.88 8.86 17.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 70.41 110.894 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.513 ' HE2' HG22 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 21.2 p -109.07 -37.12 5.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.113 -1.403 . . . . 70.05 110.829 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 66.65 130.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 73.44 110.853 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.616 HG21 ' HB3' ' A' ' 141' ' ' ASP . 6.0 m -50.22 133.51 10.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 65.13 111.112 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.49 74.48 1.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 71.14 110.892 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.8 mttp -68.5 153.74 95.32 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.627 0.727 . . . . 74.54 110.911 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 114.12 3.6 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.721 2.28 . . . . 71.52 112.334 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 CA-C-O 119.102 -0.832 . . . . 72.32 112.505 -179.99 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 CA-C-O 121.444 0.469 . . . . 41.23 112.517 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 99.33 0.74 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.713 2.275 . . . . 74.2 112.339 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.412 HD22 ' CE ' ' A' ' 80' ' ' MET . 0.2 OUTLIER 69.04 -74.95 0.07 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 72.21 110.863 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 173.05 -41.72 0.16 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.714 -0.755 . . . . 70.42 112.527 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 69.1 p -130.83 56.25 1.8 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.867 0.365 . . . . 73.42 110.881 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.412 ' CE ' HD22 ' A' ' 77' ' ' LEU . 4.7 mtt -129.61 74.2 80.98 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.529 0.68 . . . . 73.41 110.832 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -7.0 19.96 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.693 2.262 . . . . 65.11 112.283 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.448 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 32.4 p-90 -101.51 -30.73 11.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.439 . . . . 74.44 110.888 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -89.91 108.1 19.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.279 -0.419 . . . . 71.43 110.936 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 17.7 m-70 -83.44 -46.97 11.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 50.12 110.891 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.89 33.0 71.57 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.707 -0.759 . . . . 54.3 112.538 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.61 33.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.712 0.292 . . . . 65.2 110.922 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.4 HG21 ' HB2' ' A' ' 92' ' ' ALA . 7.4 mm -103.3 144.07 14.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.42 111.072 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.19 159.35 16.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.125 -0.488 . . . . 73.12 111.213 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -54.14 -37.94 64.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 74.33 110.904 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -77.15 -32.05 56.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.232 -0.44 . . . . 73.03 110.829 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -70.09 -39.49 75.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 72.03 110.915 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.472 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -74.99 -35.99 62.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 70.5 111.151 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -58.87 -52.85 63.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 34.21 110.927 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.75 -35.63 80.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.495 . . . . 72.2 110.862 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 92' ' ' ALA . 11.5 mt -54.9 -38.49 67.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 74.54 110.926 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.701 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -98.46 43.67 1.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 64.02 110.949 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.503 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -67.72 -59.92 6.15 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.622 0.725 . . . . 75.34 110.912 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.9 Cg_endo -69.68 123.35 10.04 Favored 'Trans proline' 0 N--CA 1.465 -0.195 0 C-N-CA 122.73 2.287 . . . . 73.04 112.347 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 117.67 5.22 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.68 2.254 . . . . 75.31 112.333 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.9 105.29 2.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.217 -0.447 . . . . 73.4 110.862 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.691 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.0 OUTLIER -58.64 111.9 1.42 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.127 -0.488 . . . . 63.14 111.11 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.32 -5.09 6.32 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.718 -0.753 . . . . 64.11 112.511 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.2 tp -91.31 117.49 29.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.876 0.37 . . . . 74.23 110.924 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.503 ' HB3' HD22 ' A' ' 167' ' ' LEU . 23.9 p90 -128.5 166.79 18.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.164 -0.471 . . . . 72.31 110.885 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.651 HD23 HD21 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -164.23 138.72 5.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.122 -0.49 . . . . 74.41 110.874 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.448 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 92.9 t -109.92 131.19 61.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.155 -0.475 . . . . 71.12 111.211 179.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.26 145.71 41.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 71.2 110.879 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.76 123.92 8.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 74.14 110.893 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.5 m -62.16 109.3 1.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 51.42 110.856 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.584 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.5 m -68.69 -56.31 8.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 73.33 111.167 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.54 ' CG ' HD12 ' B' ' 310' ' ' ILE . 67.2 m-80 -64.38 -27.04 68.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.196 -0.457 . . . . 65.12 110.823 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.413 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 2.4 m-85 -118.43 95.73 49.03 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.677 0.751 . . . . 65.2 110.869 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.6 Cg_endo -69.77 114.34 3.67 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.638 2.225 . . . . 61.24 112.368 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.41 -1.18 25.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.729 -0.748 . . . . 72.0 112.532 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -123.47 -172.97 2.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.789 0.328 . . . . 72.51 110.832 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -139.98 145.12 37.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.904 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 27.4 m -113.6 141.63 46.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 63.4 111.136 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.529 ' CD2' HD11 ' A' ' 163' ' ' LEU . 0.4 OUTLIER -113.14 118.97 36.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.244 -0.434 . . . . 44.4 110.913 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 14.7 t -102.66 129.94 49.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.222 -0.445 . . . . 73.24 110.85 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.419 HG21 HD12 ' A' ' 163' ' ' LEU . 11.7 t -128.53 150.01 33.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 74.03 111.092 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.701 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -102.12 112.45 25.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 74.41 110.895 -179.828 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.13 91.46 3.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.116 -0.493 . . . . 62.14 110.862 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 66.35 32.21 7.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 73.0 110.896 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.34 -13.76 64.15 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.712 -0.756 . . . . 54.14 112.476 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.03 145.69 25.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.833 0.349 . . . . 70.32 110.909 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.485 ' O ' HD13 ' B' ' 294' ' ' LEU . 6.8 m -106.08 116.38 49.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 63.42 111.166 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -107.28 122.8 47.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 74.53 110.822 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -99.78 124.16 44.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 62.32 110.804 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.635 ' CE1' HD13 ' A' ' 163' ' ' LEU . 56.4 m-85 -110.8 116.99 32.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 54.14 110.881 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 129.73 40.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 75.55 110.78 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.497 HG12 HD11 ' A' ' 140' ' ' ILE . 33.3 mt -113.66 109.41 28.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 45.33 111.153 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -81.41 125.22 30.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 31.23 110.913 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.46 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.97 101.06 8.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.261 -0.427 . . . . 73.53 110.907 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -137.36 142.55 41.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 74.11 110.894 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.66 35.87 24.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 73.54 111.158 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 2.7 t 60.26 31.87 20.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 62.44 110.795 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mtmm -137.92 142.56 40.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.174 -0.466 . . . . 74.32 110.884 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.46 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 4.4 mp -105.64 152.2 23.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 70.41 110.929 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -169.59 139.94 2.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.449 . . . . 73.45 110.816 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.524 ' CG2' HG13 ' B' ' 317' ' ' VAL . 58.4 mt -115.65 -37.14 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.078 -0.51 . . . . 74.33 111.145 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.65 ' HB3' HG21 ' B' ' 317' ' ' VAL . 23.6 p30 -89.19 -5.26 57.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 75.13 110.915 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 61.98 15.87 7.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.471 . . . . 62.14 110.901 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -123.79 -9.19 7.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.074 -0.512 . . . . 74.24 110.896 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 5.5 t -143.48 104.53 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.101 -0.5 . . . . 62.52 111.073 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -94.99 145.47 24.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 53.12 110.89 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.432 ' CD1' HD12 ' A' ' 152' ' ' LEU . 49.3 m-85 -117.09 178.05 4.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 73.32 110.869 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -100.68 -15.69 17.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 64.54 110.92 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.429 ' C ' HD13 ' A' ' 138' ' ' LEU . 1.5 t30 -165.76 172.07 12.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 71.33 110.849 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.5 -23.26 58.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 62.22 110.894 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.5 ttp -62.55 -57.19 12.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 63.42 110.864 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -65.73 -35.66 81.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.198 -0.456 . . . . 71.11 110.97 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.432 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.54 -48.46 74.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.466 . . . . 64.31 110.958 179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.77 HG13 HD12 ' A' ' 167' ' ' LEU . 71.0 t -64.79 -38.01 81.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.489 . . . . 75.12 111.124 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -55.4 -38.32 68.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 73.42 110.904 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -72.22 -45.2 61.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.43 110.826 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.526 ' CD1' HD23 ' A' ' 163' ' ' LEU . 32.5 m-85 -69.92 -15.82 63.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 75.1 110.968 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.421 HG23 ' O ' ' A' ' 167' ' ' LEU . 96.8 m -86.96 -34.16 19.4 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.079 -0.509 . . . . 74.32 111.128 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 6.5 t -80.09 -23.45 41.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 60.04 111.164 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.25 153.65 24.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 64.12 110.855 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.51 -58.16 7.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 41.53 111.116 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 56.21 25.19 8.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 55.2 110.928 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 119.28 -11.3 11.5 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.742 -0.742 . . . . 71.42 112.483 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.635 HD13 ' CE1' ' A' ' 129' ' ' TYR . 3.8 mm? -86.93 138.38 31.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.896 0.379 . . . . 70.32 110.894 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 19.5 t -51.23 -29.51 14.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.141 -0.481 . . . . 72.02 110.856 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.467 HG21 HG22 ' A' ' 101' ' ' THR . 4.5 t -158.99 128.13 5.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 72.4 111.095 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -51.62 139.53 20.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.436 . . . . 73.21 110.928 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.77 HD12 HG13 ' A' ' 153' ' ' VAL . 8.5 mt -60.95 139.54 58.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.258 -0.428 . . . . 65.24 110.874 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.691 HD12 ' O ' ' A' ' 101' ' ' THR . 26.4 mt -127.13 -51.5 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 53.51 111.148 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -128.15 122.04 21.94 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.578 0.704 . . . . 72.22 110.932 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 138.45 37.99 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.753 2.302 . . . . 72.52 112.329 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.42 84.03 0.4 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 61.42 110.899 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 28.7 m -64.38 138.52 22.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.438 . . . . 71.52 111.174 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 2.1 ptm . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.209 -0.45 . . . . 75.45 110.844 179.992 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 CA-C-O 121.431 0.462 . . . . 65.01 112.445 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 169.88 17.9 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 73.52 112.321 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 10.4 mp -56.74 -41.6 77.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 73.42 110.87 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 73.37 30.57 62.33 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.779 -0.724 . . . . 71.11 112.471 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 5.8 t -78.29 73.5 4.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.962 0.41 . . . . 71.01 110.901 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 38.1 tttt -158.54 129.0 6.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.109 -0.496 . . . . 63.54 110.899 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -173.18 176.36 2.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 62.53 110.856 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -174.41 66.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 73.35 110.847 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 53.8 p -176.93 121.55 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.842 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.75 108.63 0.79 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.145 -0.479 . . . . 71.2 110.86 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.485 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER -163.92 102.34 0.89 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.473 . . . . 65.52 110.899 -179.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 4.4 p -96.72 88.88 4.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 61.24 110.859 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -77.0 145.64 37.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.11 -0.495 . . . . 73.55 110.962 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -136.7 129.58 30.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.088 -0.505 . . . . 63.34 110.888 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . 0.584 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -91.82 164.31 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.276 -0.42 . . . . 62.5 110.853 -179.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 28.6 mtt180 -67.78 -12.47 60.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 61.42 110.889 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.23 -37.84 66.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 71.54 110.889 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -95.93 -16.84 21.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.139 -0.482 . . . . 73.23 110.904 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.531 ' HB2' HD11 ' B' ' 305' ' ' LEU . 31.5 m-20 -153.73 79.08 5.39 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.646 0.736 . . . . 70.2 110.912 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.68 -6.57 18.88 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.709 2.272 . . . . 60.04 112.33 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 15.3 t -93.78 27.24 2.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 43.44 111.113 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' B' ' 302' ' ' ASP . 44.5 mt -101.31 136.79 40.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.202 -0.454 . . . . 62.32 110.985 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.59 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.0 t -103.17 169.99 8.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 52.53 111.103 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -49.66 -32.5 13.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.185 -0.461 . . . . 75.21 110.856 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -63.98 -47.64 79.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 60.23 110.875 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.59 ' HG2' HG22 ' B' ' 306' ' ' THR . 3.4 mm-40 -65.34 -49.27 70.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 54.14 110.879 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.54 HD12 ' CG ' ' A' ' 111' ' ' ASN . 24.3 mm -61.54 -53.24 51.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 65.11 111.202 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 79.3 p -58.57 -23.39 58.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 73.04 110.855 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -78.79 -1.63 35.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.479 . . . . 60.02 111.062 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -114.7 10.32 16.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 74.43 110.931 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 1.7 t -97.67 -33.7 11.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 114.091 -1.413 . . . . 63.12 110.808 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 5.8 t 65.12 151.69 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 73.05 110.838 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.65 HG21 ' HB3' ' A' ' 141' ' ' ASP . 6.8 m -59.02 120.32 4.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.093 -0.503 . . . . 71.04 111.14 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -127.34 74.85 1.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 71.03 110.918 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -63.82 160.59 44.42 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.654 0.74 . . . . 74.23 110.881 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.85 113.0 3.24 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.687 2.258 . . . . 64.31 112.333 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.37 0 CA-C-O 119.132 -0.816 . . . . 63.52 112.517 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 121.417 0.454 . . . . 74.32 112.505 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -44.15 2.25 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.674 2.249 . . . . 63.2 112.366 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.3 mp -108.56 -33.33 7.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.21 -0.45 . . . . 73.23 110.94 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 169.64 -46.03 0.21 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.748 -0.739 . . . . 62.31 112.454 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 12.9 p -166.21 54.89 0.1 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.897 0.38 . . . . 61.24 110.834 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 28.0 mtt -129.4 73.61 81.5 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.57 0.7 . . . . 61.25 110.883 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.77 -7.77 21.91 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.643 2.229 . . . . 71.11 112.379 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.469 ' CH2' HG21 ' A' ' 153' ' ' VAL . 37.0 p-90 -100.2 -25.99 14.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.465 . . . . 65.05 110.918 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -98.73 103.14 15.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.249 -0.432 . . . . 75.24 110.913 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -79.58 -45.43 19.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 65.11 110.938 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 60.82 35.31 89.88 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.699 -0.762 . . . . 60.02 112.497 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.3 34.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.743 0.306 . . . . 73.51 110.885 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.605 HG23 ' HB3' ' A' ' 91' ' ' GLN . 16.7 mm -109.19 144.96 16.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 72.21 111.133 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -97.76 177.5 5.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 72.22 111.141 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ppt_? -65.35 -40.7 93.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 65.24 110.872 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -38.06 89.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 65.2 110.889 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.605 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -76.11 -37.7 57.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 72.14 110.93 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.61 -36.26 78.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 71.42 111.089 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -67.83 -53.06 29.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.158 -0.474 . . . . 71.34 110.913 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.09 -35.0 79.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 72.42 110.82 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.17 -36.02 82.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 70.53 110.94 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.588 HD12 ' CB ' ' A' ' 121' ' ' SER . 2.6 mm? -103.19 43.44 1.08 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.18 -0.464 . . . . 71.41 110.951 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.494 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.27 -60.12 4.41 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.776 0.798 . . . . 73.42 110.914 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.8 Cg_endo -69.74 123.32 9.99 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.627 2.218 . . . . 72.54 112.388 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.78 118.14 5.5 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.72 2.28 . . . . 63.34 112.297 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -155.01 111.08 3.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 73.01 110.884 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.631 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -63.16 112.69 2.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.068 -0.515 . . . . 65.32 111.154 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.97 -6.94 6.43 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.809 -0.71 . . . . 61.01 112.556 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.458 HD12 ' O ' ' A' ' 169' ' ' LYS . 2.4 tp -90.26 114.6 26.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.842 0.353 . . . . 75.03 110.835 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.667 ' HB3' HD22 ' A' ' 167' ' ' LEU . 20.2 p90 -126.24 164.34 21.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 74.33 110.927 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.586 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -161.24 136.45 7.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 63.13 110.928 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.432 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 86.2 t -110.19 132.84 57.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 72.34 111.161 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -142.3 149.96 40.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 73.12 110.846 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.22 124.05 15.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 72.53 110.911 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.8 m -60.02 112.6 1.94 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 61.24 110.857 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.9 m -68.68 -53.29 23.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 75.41 111.161 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.418 ' CG ' HD12 ' B' ' 310' ' ' ILE . 6.6 m-80 -63.86 -29.45 70.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.215 -0.448 . . . . 54.2 110.9 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -123.45 97.4 42.45 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.648 0.737 . . . . 72.15 110.983 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.68 123.85 10.54 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.654 2.236 . . . . 73.22 112.398 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.61 -14.99 22.26 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.763 -0.732 . . . . 74.43 112.453 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -116.15 -175.34 2.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.777 0.322 . . . . 62.44 110.809 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -135.92 156.63 48.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 71.15 110.95 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 92.3 m -128.05 131.06 49.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 54.14 111.173 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.01 124.36 43.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.288 -0.415 . . . . 72.41 110.988 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 12.9 t -108.44 125.79 52.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 64.05 110.89 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.1 t -124.86 151.57 30.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.24 111.195 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.588 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.6 OUTLIER -101.9 111.24 23.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 74.14 110.818 -179.834 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.28 89.73 3.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 52.23 110.93 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 67.97 31.71 5.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 71.33 110.799 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.94 -14.48 62.71 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.738 -0.744 . . . . 74.32 112.515 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -88.09 139.79 30.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.839 0.352 . . . . 73.33 110.941 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.475 HG23 ' HB3' ' B' ' 294' ' ' LEU . 7.3 m -100.44 106.74 19.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 75.24 111.085 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -95.77 121.31 37.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.122 -0.49 . . . . 62.51 110.949 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 -100.75 124.88 47.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 73.51 110.848 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -112.66 120.24 40.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.169 -0.469 . . . . 73.34 110.882 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -67.86 133.11 48.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.1 -0.5 . . . . 75.03 110.91 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 49.7 mt -117.34 107.63 22.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 73.32 111.129 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 1.6 ttm -83.01 123.34 29.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 74.25 110.888 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.467 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -114.07 100.8 8.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.312 -0.404 . . . . 73.11 110.949 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -136.36 142.5 43.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.11 -0.496 . . . . 75.4 110.801 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 58.17 35.99 25.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 75.52 111.114 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.4 t 60.33 29.76 19.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.239 -0.437 . . . . 72.1 110.811 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -136.31 140.99 43.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 74.14 110.873 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.581 HD21 ' HG ' ' A' ' 149' ' ' LEU . 5.0 mp -101.93 153.72 19.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 64.03 110.915 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.59 139.21 2.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.48 . . . . 71.21 110.863 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.449 HD12 ' CZ ' ' A' ' 156' ' ' TYR . 50.1 mt -115.5 -28.9 2.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 71.01 111.108 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -101.14 -5.32 25.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.161 -0.472 . . . . 71.03 110.873 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 63.63 14.62 8.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 70.32 110.835 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -119.42 -19.74 8.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.446 . . . . 74.03 110.918 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.3 t -133.7 104.3 6.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.108 -0.497 . . . . 64.53 111.128 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -94.04 144.87 25.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.218 -0.447 . . . . 75.24 110.9 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -113.04 175.08 5.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.124 -0.489 . . . . 73.11 110.874 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -96.02 -16.91 21.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.141 -0.481 . . . . 61.34 110.861 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -173.77 158.82 3.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 52.3 110.893 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.581 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.9 OUTLIER -51.5 -36.31 44.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 74.33 110.935 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.9 ttp -52.29 -51.39 58.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 52.5 110.902 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -66.0 -39.63 90.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 75.45 110.944 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.67 -53.41 56.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 74.14 110.907 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.509 HG13 HD12 ' A' ' 167' ' ' LEU . 69.4 t -61.5 -36.7 74.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 74.11 111.118 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -54.99 -40.27 69.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.166 -0.47 . . . . 74.03 110.903 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.21 -52.3 17.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.449 . . . . 73.14 110.891 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.676 ' CD1' HD13 ' A' ' 163' ' ' LEU . 63.1 m-85 -62.72 -17.15 60.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 74.34 110.94 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.3 m -87.44 -32.79 19.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.085 -0.507 . . . . 63.03 111.126 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 19.3 m -77.46 -21.56 52.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.254 -0.43 . . . . 72.23 111.182 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.74 176.35 4.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 74.32 110.832 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.88 -58.13 6.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 65.14 111.111 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.81 19.68 8.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 72.15 110.855 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . 0.846 ' HA3' HG23 ' B' ' 317' ' ' VAL . . . 116.66 -8.45 17.14 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.742 -0.742 . . . . 64.41 112.423 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.676 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.1 mp -94.5 148.06 22.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.863 0.363 . . . . 75.23 110.869 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 22.1 p -54.35 -27.25 34.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 75.32 110.983 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.504 HG21 HG22 ' A' ' 101' ' ' THR . 14.7 t -159.55 133.74 7.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.126 -0.488 . . . . 62.55 111.101 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 2.3 ptt-85 -53.93 173.14 0.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 72.33 110.91 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.667 HD22 ' HB3' ' A' ' 104' ' ' PHE . 15.0 mt -93.82 141.73 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 71.51 110.895 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.631 HD12 ' O ' ' A' ' 101' ' ' THR . 30.4 mt -125.41 -51.19 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.194 -0.457 . . . . 64.23 111.213 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . 0.458 ' O ' HD12 ' A' ' 103' ' ' LEU . 8.3 mmtt -128.81 122.4 21.47 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.563 0.697 . . . . 73.31 110.886 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 138.41 37.56 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.635 2.223 . . . . 73.23 112.352 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.81 84.55 0.31 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 63.13 110.899 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.1 m -64.32 135.28 28.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 74.23 111.1 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.5 mtm . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 65.01 110.847 179.87 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 CA-C-O 121.466 0.481 . . . . 53.32 112.5 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.86 163.92 36.55 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.704 2.269 . . . . 70.41 112.335 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 36.5 mt -52.66 -32.48 42.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.26 -0.427 . . . . 50.12 110.865 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 111.44 -31.95 6.79 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.775 -0.726 . . . . 74.11 112.537 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 4.5 m -88.32 94.56 9.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.996 0.427 . . . . 64.45 110.871 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.13 140.01 18.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 71.3 110.887 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 3.4 mtt180 -179.87 92.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 74.21 110.895 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 5.3 t80 179.06 106.64 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 75.54 110.867 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 46.0 t -90.61 105.34 17.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 74.04 110.891 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -171.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.185 -0.461 . . . . 60.32 110.814 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.475 ' HB3' HG23 ' A' ' 126' ' ' VAL . 0.0 OUTLIER -153.18 104.53 2.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 73.41 110.896 -179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -91.64 88.56 6.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.183 -0.462 . . . . 53.1 110.883 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -77.91 126.78 31.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.151 -0.477 . . . . 72.24 110.912 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -123.77 128.26 49.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.094 -0.503 . . . . 62.21 110.879 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 5.8 m -88.99 165.24 14.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 74.44 110.92 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -59.53 -19.16 46.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 53.22 110.886 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -37.01 82.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 74.13 110.887 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -104.28 -21.1 13.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 64.51 110.854 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.49 ' HB2' HD11 ' B' ' 305' ' ' LEU . 3.6 m-20 -141.57 77.22 19.63 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.618 0.723 . . . . 74.14 110.813 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 -6.76 19.37 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.732 2.288 . . . . 75.32 112.328 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 10.4 t -93.79 27.45 2.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.192 -0.458 . . . . 63.04 111.152 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.49 HD11 ' HB2' ' B' ' 302' ' ' ASP . 48.3 mt -100.84 136.96 39.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.192 -0.458 . . . . 75.32 110.89 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.592 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.6 t -108.84 174.35 5.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 75.13 111.183 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -50.26 -35.37 26.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.254 -0.43 . . . . 71.13 110.847 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . 0.42 ' H ' HG23 ' B' ' 306' ' ' THR . 1.2 tm-20 -63.16 -46.88 85.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.131 -0.486 . . . . 73.22 110.935 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.592 ' HG2' HG22 ' B' ' 306' ' ' THR . 11.6 mm-40 -68.4 -47.58 66.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.137 -0.483 . . . . 72.33 110.889 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.6 HG23 ' O3P' ' B' ' 314' ' ' PTR . 44.2 mm -56.03 -45.41 80.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 75.22 111.124 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 59.0 p -76.67 -15.86 59.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 70.15 110.859 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -74.92 -17.27 60.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.103 -0.499 . . . . 62.51 111.066 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 1.5 ptp -109.8 15.17 22.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 32.11 110.875 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.6 ' O3P' HG23 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 13.7 t -77.7 -39.56 44.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.071 -1.422 . . . . 62.35 110.808 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.1 p 67.28 131.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 73.35 110.894 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.846 HG23 ' HA3' ' A' ' 162' ' ' GLY . 2.1 p -48.59 130.88 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.131 -0.486 . . . . 63.22 111.112 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -146.72 74.65 1.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 64.24 110.868 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 8.7 mttt -58.94 160.61 10.62 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.582 0.706 . . . . 74.24 110.847 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 112.06 2.98 Favored 'Trans proline' 0 C--N 1.34 0.129 0 C-N-CA 122.727 2.285 . . . . 51.15 112.37 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.684 -0.77 . . . . 50.0 112.511 -179.966 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 CA-C-O 121.414 0.452 . . . . 44.34 112.507 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 -46.33 1.23 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.63 2.22 . . . . 55.24 112.339 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.63 -30.82 8.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 64.31 110.932 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -179.57 -59.97 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.746 -0.74 . . . . 32.32 112.472 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 73.1 m -161.62 63.07 0.26 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.819 0.343 . . . . 64.53 110.837 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -134.15 73.9 68.96 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.58 0.705 . . . . 72.42 110.892 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -7.97 22.4 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.69 2.26 . . . . 73.1 112.319 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.406 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 41.5 p-90 -102.18 -26.15 13.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.23 -0.441 . . . . 74.43 110.893 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -96.01 99.7 11.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 75.13 110.857 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.8 m-70 -75.63 -36.68 60.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.148 -0.478 . . . . 65.02 110.926 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.71 27.36 58.83 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.703 -0.761 . . . . 61.35 112.52 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.46 63.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.83 0.348 . . . . 74.41 110.973 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 15.3 mm -126.76 144.0 38.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.468 . . . . 62.22 111.13 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.466 HG22 ' H ' ' A' ' 89' ' ' ARG . 0.2 OUTLIER -93.93 171.83 8.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 74.21 111.173 179.906 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.466 ' H ' HG22 ' A' ' 88' ' ' THR . 6.6 ppt_? -63.32 -38.24 90.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 74.42 110.839 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -76.63 -30.84 57.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 73.44 110.991 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -70.9 -43.28 68.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.099 -0.501 . . . . 74.03 110.957 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.472 ' HA ' HD12 ' A' ' 95' ' ' LEU . . . -72.72 -37.26 67.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.182 -0.463 . . . . 74.44 111.152 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -57.79 -53.1 62.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 71.42 110.906 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.84 -33.91 74.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 71.33 110.841 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 92' ' ' ALA . 9.8 mt -54.69 -38.23 66.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 52.33 110.925 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.662 HD21 HD23 ' A' ' 105' ' ' LEU . 3.7 mm? -100.33 43.5 1.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.22 -0.446 . . . . 73.21 110.92 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.501 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -64.32 -59.94 9.75 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.678 0.751 . . . . 74.1 110.941 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.4 Cg_endo -69.68 123.15 9.84 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.64 2.227 . . . . 61.24 112.394 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.67 116.56 4.61 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 122.667 2.245 . . . . 74.22 112.37 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -154.99 108.76 2.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.43 . . . . 61.21 110.901 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.0 OUTLIER -61.61 111.93 2.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 62.2 111.15 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.66 -6.82 6.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.731 -0.747 . . . . 64.42 112.511 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 tp -89.73 111.95 23.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.836 0.351 . . . . 71.44 110.899 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.406 ' CD2' HD13 ' A' ' 167' ' ' LEU . 23.7 p90 -124.05 167.94 13.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 74.45 110.878 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.662 HD23 HD21 ' A' ' 96' ' ' LEU . 0.9 OUTLIER -164.67 135.22 4.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.915 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.406 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 88.6 t -110.25 138.35 38.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.472 . . . . 72.11 111.074 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -150.66 154.32 37.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.096 -0.502 . . . . 74.32 110.851 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -51.85 124.39 12.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 63.54 110.92 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.9 m -63.84 113.39 3.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.226 -0.443 . . . . 73.13 110.861 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.6 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.1 m -68.9 -56.35 8.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.109 -0.496 . . . . 65.21 111.173 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.603 ' CG ' HD12 ' B' ' 310' ' ' ILE . 23.2 m-80 -68.67 -23.86 64.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 64.44 110.942 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -115.42 94.77 40.88 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.693 0.759 . . . . 74.15 111.004 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 109.94 2.43 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.659 2.24 . . . . 73.13 112.372 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.43 3.49 24.04 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.723 -0.751 . . . . 72.24 112.536 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 76.7 m-20 -129.4 -175.84 3.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.819 0.342 . . . . 71.0 110.92 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -135.93 144.87 45.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 74.21 110.948 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.7 m -108.58 141.59 40.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 71.44 111.144 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.529 ' CD2' HD11 ' A' ' 163' ' ' LEU . 0.4 OUTLIER -114.79 107.98 16.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 71.13 110.891 179.989 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . 0.564 ' SG ' HG13 ' A' ' 126' ' ' VAL . 10.5 t -93.07 134.9 34.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 61.34 110.878 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.0 t -138.07 148.35 25.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 63.42 111.126 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.653 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -100.51 111.64 23.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 61.51 110.905 -179.869 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -113.86 91.49 3.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.142 -0.481 . . . . 71.12 110.856 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 66.38 31.55 8.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 74.24 110.913 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.98 -13.28 63.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.741 -0.742 . . . . 52.43 112.544 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -87.96 140.0 29.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.799 0.333 . . . . 72.15 110.887 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.564 HG13 ' SG ' ' A' ' 119' ' ' CYS . 57.7 t -98.77 108.15 21.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 75.42 111.13 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -101.67 128.52 47.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 74.44 110.909 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 -105.41 125.04 50.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 75.34 110.874 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.615 ' CE1' HD13 ' A' ' 163' ' ' LEU . 49.3 m-85 -112.71 116.72 30.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.469 . . . . 60.23 110.909 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.22 137.19 44.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.125 -0.489 . . . . 72.31 110.811 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.451 HG12 HD11 ' A' ' 140' ' ' ILE . 39.8 mt -118.17 109.59 27.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 72.33 111.093 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -80.85 124.19 28.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 71.5 110.94 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.482 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -113.39 98.19 6.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.24 -0.436 . . . . 71.14 110.917 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -131.51 142.6 49.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.051 -0.522 . . . . 72.31 110.862 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 55.98 35.97 26.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.222 -0.445 . . . . 63.31 111.107 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 61.08 30.24 19.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.238 -0.437 . . . . 63.03 110.906 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 8.9 mtmt -134.82 141.09 46.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.094 -0.503 . . . . 72.3 110.917 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.532 HD21 ' HG ' ' A' ' 149' ' ' LEU . 4.9 mp -102.39 149.52 24.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.442 . . . . 74.22 110.892 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 14.0 t -166.9 137.8 3.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 63.35 110.861 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.645 HG22 HG13 ' B' ' 317' ' ' VAL . 53.2 mt -115.7 -32.16 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.51 . . . . 73.41 111.16 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.572 ' CB ' HG21 ' B' ' 317' ' ' VAL . 49.3 t0 -97.39 10.6 39.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 71.23 110.89 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 9.7 pt-20 45.96 29.89 0.82 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.157 -0.474 . . . . 71.41 110.888 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -132.51 -40.08 1.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 73.42 110.867 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.445 HG13 ' O ' ' A' ' 144' ' ' VAL . 2.7 p -116.28 104.62 16.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 73.24 111.11 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -93.41 150.75 20.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 72.31 110.952 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.474 ' CD1' HD12 ' A' ' 152' ' ' LEU . 44.8 m-85 -121.08 178.2 4.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.193 -0.458 . . . . 74.22 110.896 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -100.37 -16.08 17.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 75.25 110.891 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.476 ' C ' HD13 ' A' ' 138' ' ' LEU . 1.2 t30 -164.88 172.5 12.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 64.34 110.853 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.532 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.5 OUTLIER -74.6 -27.55 60.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 70.32 110.893 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.7 -57.21 14.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.195 -0.457 . . . . 61.1 110.85 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -66.04 -36.36 83.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.23 -0.441 . . . . 63.32 110.951 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.474 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -55.63 -49.52 72.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.926 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.616 HG13 HD12 ' A' ' 167' ' ' LEU . 71.3 t -63.42 -38.36 81.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 75.41 111.121 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.99 -39.35 68.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 73.14 110.844 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -71.42 -44.55 64.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 74.24 110.817 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -68.26 -20.81 64.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 64.24 110.925 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 67.2 m -84.66 -30.39 24.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 53.34 111.161 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 13.2 m -79.68 -25.12 41.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.268 -0.424 . . . . 64.35 111.123 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -162.27 155.48 20.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.256 -0.429 . . . . 74.51 110.898 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.455 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -51.35 -58.4 6.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 73.4 111.089 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 51.77 29.81 6.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.469 . . . . 73.54 110.876 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 120.57 -14.7 9.92 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.735 -0.745 . . . . 62.14 112.462 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.615 HD13 ' CE1' ' A' ' 129' ' ' TYR . 4.0 mm? -88.13 136.9 32.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.915 0.388 . . . . 74.34 110.939 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . 0.424 ' SG ' HG22 ' A' ' 165' ' ' THR . 19.3 p -53.86 -26.46 24.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.466 . . . . 53.31 110.851 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.424 HG22 ' SG ' ' A' ' 164' ' ' CYS . 10.2 t -157.58 127.55 6.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 72.0 111.151 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -54.98 140.44 37.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 75.35 110.841 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.616 HD12 HG13 ' A' ' 153' ' ' VAL . 8.1 mt -60.31 141.44 56.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.464 . . . . 71.34 110.901 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 101' ' ' THR . 24.2 mt -126.97 -51.41 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 63.24 111.081 179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -131.68 124.27 19.8 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.538 0.685 . . . . 75.0 110.922 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.89 136.65 33.17 Favored 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.664 2.243 . . . . 73.52 112.296 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.73 85.0 0.31 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 61.21 110.89 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 25.2 m -64.12 133.17 29.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 73.32 111.118 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 28.4 mtp . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 60.32 110.911 179.921 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 CA-C-O 121.429 0.461 . . . . 74.55 112.485 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 165.91 29.34 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.627 2.218 . . . . 70.13 112.384 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 3.2 mp -58.42 -33.95 70.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.184 -0.462 . . . . 71.12 110.974 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 92.03 30.71 9.89 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.768 -0.73 . . . . 64.53 112.482 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 75.2 m -78.69 156.03 29.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.952 0.406 . . . . 75.22 110.938 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 4.3 mtmp? -101.32 161.08 13.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 71.21 110.94 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -172.71 163.55 5.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.419 . . . . 74.35 110.859 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -167.76 62.8 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.176 -0.465 . . . . 74.35 110.814 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 18.6 p -179.41 139.76 0.15 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.155 -0.475 . . . . 65.34 110.833 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 2.2 t -178.63 105.36 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 75.13 110.922 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.454 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER -163.85 100.57 0.89 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 64.12 110.934 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.83 88.82 6.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 74.14 110.86 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -77.82 147.52 35.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.159 -0.473 . . . . 72.13 111.006 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.19 129.23 19.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 62.52 110.859 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . 0.6 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -93.27 160.12 14.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 73.14 110.817 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 -61.82 -17.26 55.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 75.02 110.953 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.42 -37.13 84.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 63.34 110.909 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -97.99 -19.17 18.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.157 -0.474 . . . . 62.33 110.915 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.528 ' HB2' HD11 ' B' ' 305' ' ' LEU . 34.4 m-20 -150.98 80.08 6.74 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.608 0.718 . . . . 75.3 110.872 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 -6.58 18.94 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.652 2.234 . . . . 72.25 112.348 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.7 t -94.06 27.45 2.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 73.33 111.049 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.528 HD11 ' HB2' ' B' ' 302' ' ' ASP . 46.2 mt -100.81 136.84 40.03 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.267 -0.424 . . . . 75.11 110.959 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.594 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.8 t -105.56 171.0 7.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 73.21 111.093 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -49.57 -35.42 20.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 61.31 110.848 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -61.38 -47.78 84.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.152 -0.476 . . . . 72.42 110.903 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.594 ' HG2' HG22 ' B' ' 306' ' ' THR . 9.7 mm-40 -67.97 -52.08 39.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 73.42 110.84 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.603 HD12 ' CG ' ' A' ' 111' ' ' ASN . 40.2 mm -56.65 -53.52 40.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 72.1 111.183 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 84.1 p -57.28 -29.85 64.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 52.23 110.789 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -69.91 -10.25 57.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 72.45 111.101 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -105.5 7.73 33.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.236 -0.438 . . . . 64.04 110.854 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 24.3 p -95.49 -33.22 12.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.174 -1.375 . . . . 53.33 110.873 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.11 151.61 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 71.43 110.884 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.645 HG13 HG22 ' A' ' 140' ' ' ILE . 5.7 m -55.89 122.89 5.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.17 -0.468 . . . . 75.51 111.143 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -131.34 74.63 1.6 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 60.11 110.846 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 3.8 mtmp? -64.55 160.38 52.64 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.546 0.688 . . . . 74.31 110.886 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 111.3 2.76 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.646 2.231 . . . . 64.22 112.382 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 CA-C-O 119.093 -0.837 . . . . 64.44 112.485 -179.992 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 CA-C-O 121.415 0.453 . . . . 65.15 112.456 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -43.42 2.64 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.713 2.275 . . . . 61.31 112.316 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -107.31 -29.29 9.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.198 -0.455 . . . . 73.04 110.898 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 158.64 -58.86 0.33 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.749 -0.738 . . . . 35.05 112.491 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.2 t -159.29 43.2 0.23 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.856 0.36 . . . . 74.1 110.926 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -133.83 70.26 75.16 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.581 0.705 . . . . 74.53 110.882 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.76 -30.34 22.46 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.741 2.294 . . . . 71.34 112.382 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.474 ' CH2' HG21 ' A' ' 153' ' ' VAL . 50.1 p-90 -54.76 -26.67 35.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 73.24 110.893 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -88.0 100.65 13.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.295 -0.411 . . . . 74.13 110.888 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -75.68 -38.39 58.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.488 . . . . 72.23 110.883 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.68 18.84 40.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.799 -0.715 . . . . 73.12 112.473 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.72 81.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.775 0.322 . . . . 75.42 110.884 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.615 HG23 ' HB3' ' A' ' 91' ' ' GLN . 29.3 mm -147.1 145.16 19.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.245 -0.434 . . . . 74.42 111.145 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -97.82 177.29 5.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 65.14 111.132 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -38.86 89.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 61.43 110.905 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -37.68 88.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.246 -0.434 . . . . 72.54 110.973 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.615 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -76.35 -37.06 57.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.077 -0.511 . . . . 70.22 110.966 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.37 -33.79 65.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 71.13 111.132 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -67.74 -53.09 30.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 73.0 110.923 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.16 -39.26 94.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 73.44 110.853 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.504 HD22 ' HE2' ' A' ' 171' ' ' LYS . 15.1 mt -58.97 -37.57 77.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 72.12 110.942 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.649 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.1 mm? -100.88 43.07 1.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.442 . . . . 75.42 110.902 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.496 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -70.01 -59.92 3.98 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.668 0.747 . . . . 74.23 110.924 -179.978 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.0 Cg_endo -69.74 124.05 10.71 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.771 2.314 . . . . 74.11 112.309 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 117.32 5.01 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.648 2.232 . . . . 74.42 112.407 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -155.09 102.6 2.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 62.51 110.884 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.668 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.2 OUTLIER -56.03 111.51 0.96 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 71.34 111.142 -179.926 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 131.28 -10.5 5.59 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.755 -0.736 . . . . 60.52 112.47 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -86.71 111.64 20.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.823 0.344 . . . . 63.15 110.933 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.418 ' HB2' HD11 ' A' ' 118' ' ' LEU . 21.0 p90 -124.2 162.38 23.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 70.45 110.888 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.644 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -159.11 135.76 9.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 75.1 110.931 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 93.1 t -109.9 134.71 51.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.221 -0.445 . . . . 54.01 111.078 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 7.5 ptt85 -148.27 141.67 25.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.451 . . . . 74.14 110.941 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -51.29 128.65 22.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 52.33 110.906 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.23 116.87 3.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 74.31 110.861 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.511 HG21 ' HG2' ' B' ' 300' ' ' GLU . 9.8 m -70.23 -26.28 63.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 52.42 111.121 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -106.68 -0.91 23.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.2 -0.455 . . . . 71.34 110.946 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.415 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 0.6 OUTLIER -139.95 90.41 10.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.641 0.734 . . . . 70.31 110.969 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 54.2 Cg_endo -69.75 118.34 5.62 Favored 'Trans proline' 0 C--N 1.34 0.131 0 C-N-CA 122.648 2.232 . . . . 74.2 112.345 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 114.19 -14.68 21.03 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.777 -0.725 . . . . 65.21 112.533 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -120.14 158.84 26.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.783 0.325 . . . . 74.31 110.911 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -113.86 149.32 35.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 72.34 110.886 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.595 HG23 ' HE1' ' B' ' 314' ' ' PTR . 69.5 m -125.48 124.51 41.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 51.22 111.125 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.523 HD21 ' CG2' ' A' ' 120' ' ' VAL . 0.4 OUTLIER -96.38 134.39 39.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 70.11 110.957 179.924 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 48.8 t -116.94 127.06 53.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.198 -0.455 . . . . 53.52 110.934 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.523 ' CG2' HD21 ' A' ' 118' ' ' LEU . 14.7 t -123.68 152.82 29.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.46 . . . . 70.42 111.097 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.649 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -104.39 112.13 25.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 52.42 110.883 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.76 95.7 5.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 60.54 110.915 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 67.68 28.55 7.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.178 -0.465 . . . . 75.44 110.938 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.74 -14.39 63.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.746 -0.74 . . . . 45.14 112.51 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.1 142.45 27.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.37 . . . . 72.12 110.897 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.554 ' O ' HD13 ' B' ' 294' ' ' LEU . 12.1 m -100.57 114.28 38.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.476 . . . . 72.54 111.185 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -104.69 123.79 48.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 72.02 110.855 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -100.52 129.17 46.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.484 . . . . 51.23 110.873 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.425 ' HB3' HD13 ' A' ' 140' ' ' ILE . 62.3 m-85 -117.94 104.01 10.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.186 -0.461 . . . . 64.32 110.901 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.552 ' O ' HG23 ' A' ' 140' ' ' ILE . 0.1 OUTLIER -58.02 140.18 52.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 71.23 110.905 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.411 HG12 HD11 ' A' ' 140' ' ' ILE . 44.2 mt -124.97 109.39 22.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 71.0 111.083 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.65 131.7 36.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.485 . . . . 70.45 110.832 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.451 ' CZ ' HD11 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -117.62 102.4 9.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.24 -0.436 . . . . 73.54 110.898 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -138.76 142.59 38.8 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 75.31 110.833 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 59.06 35.96 24.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 32.43 111.117 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 59.88 31.14 20.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.431 . . . . 62.25 110.835 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -137.8 143.16 40.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.468 . . . . 74.43 110.954 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.451 HD11 ' CZ ' ' A' ' 133' ' ' TYR . 3.7 mp -105.57 152.18 23.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 64.1 110.946 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 43.9 t -169.91 141.65 2.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 61.32 110.837 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.552 HG23 ' O ' ' A' ' 130' ' ' ARG . 44.5 mt -113.31 -36.39 2.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 74.33 111.175 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.804 ' HB3' HG21 ' B' ' 317' ' ' VAL . 9.0 p30 -87.9 -1.57 58.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 62.21 110.886 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 61.07 17.38 7.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 74.04 110.812 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -126.19 -32.29 2.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 74.11 110.902 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.5 t -114.03 104.85 17.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.491 . . . . 74.14 111.068 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -97.63 144.35 27.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 62.24 110.886 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -117.72 171.58 7.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 73.31 110.892 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.23 -15.45 31.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 72.1 110.914 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -175.27 158.65 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 75.3 110.919 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.433 ' N ' HD13 ' A' ' 138' ' ' LEU . 1.0 OUTLIER -51.43 -36.73 45.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.467 . . . . 74.02 110.897 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.1 ttt -51.84 -50.17 61.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 72.32 110.956 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -67.89 -41.6 82.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 73.42 110.925 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -47.38 77.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 71.15 110.918 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.474 HG21 ' CH2' ' A' ' 82' ' ' TRP . 89.7 t -63.77 -38.03 81.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 64.21 111.074 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -57.86 -38.33 75.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.137 -0.483 . . . . 74.2 110.852 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.81 -48.16 48.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 64.45 110.858 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.45 ' CD1' HD13 ' A' ' 163' ' ' LEU . 47.2 m-85 -67.02 -20.12 65.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 64.41 110.95 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 77.9 m -84.91 -30.07 24.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 64.41 111.167 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 72.3 m -79.69 -25.01 41.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.147 -0.479 . . . . 65.4 111.193 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -161.68 167.35 25.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 71.44 110.836 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -51.11 -57.88 7.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 54.11 111.109 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.09 17.45 9.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 55.24 110.882 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.55 15.92 9.89 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.756 -0.735 . . . . 63.3 112.451 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.45 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.8 mp -112.19 137.64 50.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.894 0.378 . . . . 63.12 110.935 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 23.7 t -51.51 -30.13 19.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.178 -0.465 . . . . 73.01 110.89 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.604 ' HB ' HG22 ' A' ' 101' ' ' THR . 2.6 t -151.45 120.47 6.68 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.176 -0.466 . . . . 73.24 111.101 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.09 151.81 4.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 75.24 110.897 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.439 ' CD1' HG13 ' A' ' 153' ' ' VAL . 6.4 mt -67.56 133.85 50.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.184 -0.462 . . . . 72.42 110.878 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.668 HD12 ' O ' ' A' ' 101' ' ' THR . 24.7 mt -127.03 -51.32 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.452 . . . . 73.4 111.129 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -126.66 120.29 23.04 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.602 0.715 . . . . 75.13 110.911 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 135.08 29.52 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.677 2.251 . . . . 75.35 112.273 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . 0.504 ' HE2' HD22 ' A' ' 95' ' ' LEU . 0.3 OUTLIER -69.02 84.75 0.34 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 75.25 110.879 179.897 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 19.1 t -64.38 140.58 19.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 74.5 111.143 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 3.8 ptt? . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 65.44 110.882 179.968 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 CA-C-O 121.42 0.456 . . . . 73.14 112.512 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 161.53 45.58 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.721 2.281 . . . . 75.4 112.302 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 33.0 tp -53.32 -36.61 61.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 73.33 110.947 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 110.7 -20.25 24.97 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.756 -0.735 . . . . 72.34 112.443 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.93 144.04 27.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.903 0.383 . . . . 53.05 110.904 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -143.3 155.92 44.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.14 -0.482 . . . . 73.14 110.967 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -177.88 155.62 1.01 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.436 . . . . 71.51 110.835 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -157.14 78.34 0.89 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 75.13 110.903 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 13.1 p -174.76 89.58 0.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 74.43 110.844 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -159.27 114.42 2.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 33.51 110.817 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.554 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.0 OUTLIER -164.02 115.17 1.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 71.2 110.883 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.21 88.14 2.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.207 -0.451 . . . . 74.24 110.853 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -85.26 149.16 25.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.097 -0.501 . . . . 65.25 110.888 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.32 128.69 16.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.14 -0.482 . . . . 74.33 110.93 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.39 158.71 18.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 73.2 110.862 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 28.2 mtt180 -58.12 -20.27 39.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 64.23 110.895 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . 0.511 ' HG2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -61.94 -36.5 81.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 75.32 110.884 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -99.32 -24.69 14.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.463 . . . . 73.01 110.926 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -143.69 79.16 13.81 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.663 0.744 . . . . 73.05 110.828 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 -5.69 16.78 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.661 2.241 . . . . 72.34 112.394 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 14.7 t -92.48 27.44 2.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 71.31 111.205 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . . . . . . . . . 22.8 mt -102.9 136.71 42.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.462 . . . . 42.53 110.925 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.637 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.7 t -105.65 173.49 6.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 71.15 111.172 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -49.9 -37.4 31.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 71.34 110.84 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 34.6 tp10 -60.92 -52.14 66.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 65.51 110.932 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.637 ' HG2' HG22 ' B' ' 306' ' ' THR . 9.2 mm-40 -65.11 -51.94 58.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.07 -0.513 . . . . 74.14 110.916 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.616 HG22 ' HE2' ' B' ' 314' ' ' PTR . 45.5 mm -55.88 -54.35 27.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 63.4 111.122 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 50.6 m -62.85 -18.48 62.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 41.44 110.876 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -80.16 1.18 29.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 74.32 111.091 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 4.1 mtm -115.44 14.35 16.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.441 . . . . 73.21 110.957 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.616 ' HE2' HG22 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 38.1 t -111.42 -34.37 6.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.144 -1.389 . . . . 61.22 110.828 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 65.21 149.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 72.1 110.841 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.804 HG21 ' HB3' ' A' ' 141' ' ' ASP . 13.5 m -62.17 125.99 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 72.05 111.172 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -140.39 82.89 1.88 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 54.53 110.879 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.56 160.47 5.39 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.575 0.702 . . . . 42.12 110.912 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 113.52 3.41 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.727 2.285 . . . . 64.14 112.325 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 CA-C-O 119.142 -0.81 . . . . 51.51 112.537 179.967 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 CA-C-O 121.495 0.497 . . . . 65.04 112.472 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 -171.8 0.51 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.64 2.227 . . . . 74.2 112.382 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.9 mp -57.44 -48.05 80.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 63.53 110.947 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 169.37 -36.01 0.19 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.722 -0.751 . . . . 43.53 112.46 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 8.0 m -134.72 57.61 1.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.832 0.349 . . . . 62.25 110.789 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 7.0 mtp -129.97 73.83 81.07 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.6 0.714 . . . . 75.4 110.921 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 -7.82 22.02 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.729 2.286 . . . . 72.53 112.381 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.442 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 41.1 p-90 -102.28 -30.39 11.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.23 110.908 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -84.93 101.1 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 74.33 110.819 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.84 -37.5 58.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 75.11 110.848 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.55 18.62 38.28 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.774 -0.727 . . . . 54.13 112.52 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.92 80.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.812 0.339 . . . . 72.01 110.93 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 16.7 mm -141.42 144.29 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 75.21 111.085 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 m -98.7 160.42 14.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.15 -0.477 . . . . 63.14 111.168 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.83 -41.05 61.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.243 -0.435 . . . . 73.21 110.827 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -69.67 -36.0 75.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.257 -0.429 . . . . 70.33 110.902 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -70.28 -41.92 72.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 70.14 110.824 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.93 -33.85 59.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 45.24 111.1 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -58.81 -52.29 66.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 73.43 110.838 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.68 -37.36 79.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 64.05 110.866 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 15.3 mt -55.04 -38.29 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.215 -0.448 . . . . 63.41 110.94 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.67 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -100.32 43.61 1.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.447 . . . . 72.12 110.867 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.48 -60.13 5.13 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.68 0.752 . . . . 73.32 110.929 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.0 Cg_endo -69.76 123.43 10.09 Favored 'Trans proline' 0 C--N 1.341 0.135 0 C-N-CA 122.696 2.264 . . . . 74.1 112.311 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.85 117.89 5.36 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.693 2.262 . . . . 72.03 112.308 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -154.82 104.95 2.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 75.21 110.864 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 168' ' ' ILE . 5.0 p -57.99 111.95 1.34 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.095 -0.502 . . . . 51.43 111.132 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.52 -6.24 6.25 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.744 -0.741 . . . . 41.44 112.55 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.73 112.62 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.843 0.354 . . . . 73.25 110.913 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -123.96 166.55 15.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.436 . . . . 73.53 110.915 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.598 HD23 HD21 ' A' ' 96' ' ' LEU . 0.9 OUTLIER -162.0 136.53 6.9 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 63.33 110.903 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.442 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 86.1 t -110.05 140.35 29.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 72.54 111.101 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -153.63 146.58 24.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 63.12 110.866 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -50.79 123.92 10.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.16 -0.473 . . . . 75.25 110.899 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.4 m -59.67 113.48 2.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 74.54 110.848 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.61 HG21 ' HB2' ' B' ' 298' ' ' SER . 2.2 m -68.55 -55.87 10.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 70.44 111.143 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -63.67 -29.26 70.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 61.41 110.934 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.429 ' HA ' ' HD2' ' A' ' 113' ' ' PRO . 1.2 m-85 -119.38 97.69 50.26 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.691 0.758 . . . . 72.33 110.884 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 112' ' ' TYR . 53.6 Cg_endo -69.72 117.68 5.22 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.677 2.252 . . . . 73.34 112.347 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.61 -2.78 24.75 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.74 -0.743 . . . . 53.25 112.482 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -122.75 -176.33 3.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.866 0.365 . . . . 54.25 110.808 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -135.24 142.53 46.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 73.43 110.869 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.5 m -109.64 137.79 46.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.127 -0.488 . . . . 70.03 111.166 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -110.84 114.68 28.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 63.2 110.932 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 9.2 t -100.82 129.95 46.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.259 -0.428 . . . . 74.34 110.844 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.9 t -131.29 150.43 34.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.202 -0.454 . . . . 73.12 111.101 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.67 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -102.92 111.44 23.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.466 . . . . 74.33 110.828 -179.835 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.02 92.38 3.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.088 -0.506 . . . . 61.33 110.876 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 66.61 30.8 8.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.161 -0.472 . . . . 74.1 110.926 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 98.25 -13.64 62.99 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.727 -0.749 . . . . 73.3 112.535 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.78 140.02 29.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.855 0.359 . . . . 64.22 110.939 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.45 ' O ' HD22 ' B' ' 294' ' ' LEU . 6.7 m -101.3 105.53 17.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.266 -0.424 . . . . 63.41 111.082 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -97.11 129.67 44.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 74.34 110.855 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -106.66 124.3 49.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 73.11 110.845 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -111.96 102.98 11.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.261 -0.427 . . . . 65.54 110.95 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -59.68 140.09 56.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 71.2 110.859 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.501 HG12 HD11 ' A' ' 140' ' ' ILE . 42.2 mt -120.45 109.01 24.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.468 . . . . 63.13 111.147 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.38 130.45 40.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 75.11 110.884 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -116.74 113.51 22.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.232 -0.44 . . . . 73.24 110.886 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -146.26 136.89 24.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.113 -0.494 . . . . 74.4 110.829 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.15 35.85 23.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 75.1 111.043 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.32 30.53 15.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.269 -0.423 . . . . 62.31 110.829 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm -130.6 138.28 50.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 75.51 110.933 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.57 HD21 ' HG ' ' A' ' 149' ' ' LEU . 3.7 mp -101.16 150.47 22.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 74.43 110.915 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -168.38 134.97 1.96 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 63.32 110.827 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.501 HD11 HG12 ' A' ' 131' ' ' ILE . 51.8 mt -113.32 -40.66 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 72.22 111.107 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.771 ' HB3' HG21 ' B' ' 317' ' ' VAL . 15.9 p30 -84.49 -5.64 59.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 64.21 110.919 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 61.57 16.29 7.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.11 110.853 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -125.36 -8.15 6.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 64.23 110.897 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 6.0 t -144.35 104.5 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 63.42 111.102 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -94.76 146.77 23.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.148 -0.478 . . . . 72.33 110.902 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -117.33 176.15 5.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 63.44 110.911 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -100.44 -14.56 18.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 73.12 110.861 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.421 ' C ' HD13 ' A' ' 138' ' ' LEU . 1.9 t30 -167.05 171.87 10.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 74.34 110.918 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.57 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.6 OUTLIER -74.49 -22.72 58.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.15 -0.477 . . . . 53.34 110.907 179.95 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 4.2 ttt -61.58 -56.76 16.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 53.3 110.912 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -67.18 -36.3 81.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.248 -0.433 . . . . 70.33 110.943 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.26 -53.15 59.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 61.12 110.931 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.451 HG13 ' CD1' ' A' ' 167' ' ' LEU . 65.3 t -62.2 -36.74 76.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.238 -0.437 . . . . 53.34 111.14 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -54.78 -39.76 68.73 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.069 -0.514 . . . . 64.44 110.933 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -71.75 -49.01 42.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.13 -0.486 . . . . 73.24 110.838 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.408 ' CD1' HD13 ' A' ' 163' ' ' LEU . 38.3 m-85 -62.92 -23.67 67.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.233 -0.44 . . . . 71.11 110.939 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.553 ' OG1' HD12 ' A' ' 167' ' ' LEU . 94.1 m -83.96 -29.47 27.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.082 -0.508 . . . . 63.33 111.155 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 42.3 m -77.65 -23.52 49.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 71.11 111.164 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -165.24 160.17 18.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.205 -0.452 . . . . 71.44 110.857 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.91 -58.12 6.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 62.24 111.157 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 21.5 t70 55.87 25.11 8.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 71.22 110.834 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 118.73 -10.86 12.29 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.792 -0.718 . . . . 44.43 112.441 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.408 HD13 ' CD1' ' A' ' 156' ' ' TYR . 10.8 mp -87.21 138.66 31.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.87 0.367 . . . . 63.0 110.85 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . 0.465 ' SG ' HG22 ' A' ' 165' ' ' THR . 18.4 p -54.6 -26.31 31.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 71.13 110.936 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.465 HG22 ' SG ' ' A' ' 164' ' ' CYS . 9.2 t -157.54 124.98 5.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.133 -0.485 . . . . 61.12 111.128 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -52.66 147.9 7.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 71.3 110.815 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.553 HD12 ' OG1' ' A' ' 157' ' ' THR . 7.5 mt -65.93 138.83 58.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.1 -0.5 . . . . 74.34 110.915 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 101' ' ' THR . 24.9 mt -127.16 -51.29 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 63.45 111.094 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 14.3 mtmt -129.93 122.25 20.3 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.531 0.681 . . . . 74.23 110.873 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.86 138.95 38.69 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.689 2.259 . . . . 52.53 112.287 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 84.13 0.42 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 64.3 110.85 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 15.2 m -64.37 130.75 29.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 53.43 111.12 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.31 110.845 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 CA-C-O 121.5 0.5 . . . . 71.33 112.431 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.87 169.99 17.75 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.713 2.275 . . . . 75.11 112.346 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 5.5 mp -52.6 -49.83 64.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 60.23 110.912 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 103.38 -40.89 2.28 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.762 -0.733 . . . . 72.12 112.503 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 13.0 t -103.53 131.93 50.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.934 0.397 . . . . 75.04 110.859 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.01 173.99 15.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 70.13 110.912 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.66 111.59 2.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 63.24 110.937 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -176.74 111.43 0.09 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 65.23 110.91 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 3.3 t -89.23 89.29 7.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.111 -0.495 . . . . 74.41 110.802 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 99.2 p -60.91 -172.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.495 . . . . 52.52 110.898 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.45 HD22 ' O ' ' A' ' 126' ' ' VAL . 0.0 OUTLIER -163.83 105.48 0.93 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.142 -0.481 . . . . 73.41 110.876 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 1.4 m -100.47 88.74 3.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 72.13 110.894 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -83.53 147.27 27.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 73.32 110.97 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.1 128.82 21.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.114 -0.493 . . . . 72.32 110.937 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . 0.61 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -87.87 156.09 19.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 73.55 110.893 -179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -60.85 -18.0 53.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.853 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.2 -39.05 86.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 74.43 110.848 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -92.5 -20.49 20.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.878 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.487 ' HB2' HD11 ' B' ' 305' ' ' LEU . 30.2 m-20 -148.84 81.36 7.71 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.674 0.749 . . . . 74.45 110.902 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -6.84 19.53 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.711 2.274 . . . . 74.44 112.374 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 13.3 t -94.13 27.3 2.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.205 -0.452 . . . . 70.42 111.097 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.632 HD13 ' OE2' ' B' ' 309' ' ' GLU . 62.2 mt -100.4 136.7 39.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.264 -0.425 . . . . 74.01 110.914 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.461 HG23 ' H ' ' B' ' 309' ' ' GLU . 7.2 t -93.82 152.99 18.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.454 . . . . 74.52 111.142 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -49.1 -31.83 8.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.211 -0.45 . . . . 65.23 110.9 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.77 -54.97 40.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 60.52 110.881 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.632 ' OE2' HD13 ' B' ' 305' ' ' LEU . 0.3 OUTLIER -57.15 -32.41 66.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 70.12 110.935 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.7 HG22 ' CE2' ' B' ' 314' ' ' PTR . 27.0 mm -63.31 -53.2 48.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.468 . . . . 65.34 111.099 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.33 -21.26 63.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 70.25 110.868 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -76.88 -3.13 37.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.499 . . . . 62.04 111.139 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . 0.635 ' HE2' ' HA ' ' B' ' 310' ' ' ILE . 2.6 mtm -111.82 6.39 19.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 72.35 110.822 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.7 ' CE2' HG22 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 43.9 t -73.15 -30.6 63.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.113 -1.403 . . . . 31.32 110.812 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 65.94 145.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 71.41 110.86 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.771 HG21 ' HB3' ' A' ' 141' ' ' ASP . 6.7 m -56.63 116.29 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 61.24 111.139 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -125.21 74.89 1.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 75.35 110.88 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 13.3 mtmt -54.65 160.48 2.74 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.652 0.739 . . . . 74.51 110.919 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.69 113.45 3.37 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.619 2.212 . . . . 64.34 112.409 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 CA-C-O 119.062 -0.855 . . . . 34.53 112.462 -179.993 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 CA-C-O 121.422 0.457 . . . . 64.14 112.471 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.449 ' HB2' HD23 ' A' ' 77' ' ' LEU . 54.5 Cg_endo -69.7 -41.44 4.35 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.656 2.237 . . . . 73.32 112.422 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.449 HD23 ' HB2' ' A' ' 76' ' ' PRO . 0.5 OUTLIER -155.44 33.34 0.37 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.136 -0.483 . . . . 63.13 110.849 -179.985 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 156.35 -104.73 0.26 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.805 -0.712 . . . . 63.32 112.54 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 7.0 m -149.06 64.5 1.04 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.856 0.36 . . . . 72.11 110.855 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 37.0 mtm -135.35 74.06 61.95 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.586 0.708 . . . . 64.3 110.894 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 -7.71 21.75 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.748 2.299 . . . . 75.25 112.323 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.42 ' CH2' HG21 ' A' ' 153' ' ' VAL . 34.2 p-90 -101.51 -30.9 11.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 73.24 110.908 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -87.32 99.48 12.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 75.01 110.851 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -75.71 -33.64 60.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 74.13 110.909 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.95 19.59 37.93 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.738 -0.744 . . . . 72.32 112.449 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.08 82.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.77 0.319 . . . . 75.51 110.919 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.625 HG23 ' HB3' ' A' ' 91' ' ' GLN . 29.5 mm -146.8 145.04 19.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 72.23 111.158 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.2 p -101.14 177.34 4.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 62.04 111.096 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -41.08 97.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 63.3 110.82 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -62.91 -38.26 90.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 72.54 110.938 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.625 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -75.73 -36.23 60.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.105 -0.498 . . . . 63.03 110.962 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.41 -33.83 67.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 73.04 111.101 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -68.69 -53.14 24.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 63.21 110.878 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.17 -40.03 96.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 64.45 110.856 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 91' ' ' GLN . 14.9 mt -58.63 -38.2 77.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 73.31 110.911 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.645 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.4 mm? -101.42 43.36 1.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 75.42 110.852 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.493 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.29 -60.13 4.39 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.68 0.752 . . . . 72.35 110.902 179.924 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 54.4 Cg_endo -69.72 124.08 10.75 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.615 2.21 . . . . 70.33 112.445 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 116.92 4.78 Favored 'Trans proline' 0 C--O 1.23 0.124 0 C-N-CA 122.704 2.269 . . . . 54.23 112.325 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -154.79 110.58 3.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 62.13 110.863 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.638 ' O ' HD12 ' A' ' 168' ' ' ILE . 1.1 p -62.71 111.8 2.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 63.31 111.114 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.76 -7.07 6.17 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.74 -0.743 . . . . 72.12 112.443 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.453 HD21 ' HE3' ' A' ' 171' ' ' LYS . 3.0 tp -89.51 111.59 22.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 73.54 110.969 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.469 ' HB3' HD22 ' A' ' 167' ' ' LEU . 19.6 p90 -123.31 167.7 13.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.213 -0.449 . . . . 74.42 110.885 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.586 HD23 HD21 ' A' ' 96' ' ' LEU . 1.0 OUTLIER -162.45 134.02 5.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 45.3 110.873 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.2 t -110.03 140.04 30.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 74.51 111.067 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.5 151.65 29.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 74.35 110.884 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -51.38 124.24 11.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.192 -0.458 . . . . 70.1 110.904 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 8.6 m -59.17 112.05 1.57 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 53.1 110.86 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.601 HG21 ' HB2' ' B' ' 298' ' ' SER . 1.3 m -68.77 -56.46 7.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 61.13 111.126 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.43 ' CG ' HD12 ' B' ' 310' ' ' ILE . 30.8 m-80 -67.26 -24.99 65.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.451 . . . . 62.1 110.915 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -116.42 95.43 45.51 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.69 0.757 . . . . 75.45 110.896 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 110.52 2.58 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.66 2.24 . . . . 63.24 112.353 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.7 6.31 21.41 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.707 -0.759 . . . . 42.14 112.461 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -132.44 -177.81 4.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.797 0.332 . . . . 71.55 110.841 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -129.01 155.83 44.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 70.01 110.88 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.483 HG23 ' HE1' ' B' ' 314' ' ' PTR . 2.9 m -125.84 139.94 53.07 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.07 -0.514 . . . . 75.14 111.123 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.71 115.01 26.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.197 -0.456 . . . . 72.31 110.931 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 7.6 t -100.83 126.97 47.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.42 110.889 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 16.4 t -127.81 153.28 36.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 74.41 111.127 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.645 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -104.24 111.76 24.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.461 . . . . 72.03 110.823 -179.787 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.47 92.37 3.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.133 -0.485 . . . . 44.41 110.844 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 66.95 31.25 7.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 65.02 110.89 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.71 -14.48 62.99 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.739 -0.743 . . . . 64.31 112.511 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -87.56 143.38 27.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.796 0.331 . . . . 61.12 110.916 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.587 ' O ' HD13 ' B' ' 294' ' ' LEU . 9.9 m -103.8 112.97 39.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 71.41 111.12 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.5 pm0 -105.54 126.56 52.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 70.41 110.913 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -103.33 126.46 50.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.171 -0.468 . . . . 73.32 110.854 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.433 ' HB3' HD13 ' A' ' 140' ' ' ILE . 32.0 m-85 -110.49 116.17 30.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 71.4 110.87 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.645 ' O ' HG23 ' A' ' 140' ' ' ILE . 0.0 OUTLIER -70.04 136.92 50.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.102 -0.499 . . . . 75.23 110.885 179.99 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.426 HG12 HD11 ' A' ' 140' ' ' ILE . 81.2 mt -118.61 109.28 26.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 52.11 111.101 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.11 130.41 39.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 73.42 110.853 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -114.09 116.67 29.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 74.13 110.878 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -150.35 136.07 18.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 72.32 110.852 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.11 35.93 23.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.198 -0.456 . . . . 60.13 111.108 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.71 29.98 14.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 63.25 110.889 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -129.29 142.24 50.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 72.13 110.887 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.589 HD21 ' HG ' ' A' ' 149' ' ' LEU . 2.1 mp -106.09 148.62 27.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 71.53 110.966 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.2 t -166.95 131.29 1.97 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.226 -0.443 . . . . 74.53 110.899 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.645 HG23 ' O ' ' A' ' 130' ' ' ARG . 41.0 mt -107.48 -32.25 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 64.41 111.13 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.471 ' HA ' HG21 ' B' ' 317' ' ' VAL . 35.6 t0 -86.59 -1.17 57.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.164 -0.471 . . . . 71.3 110.845 179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 60.64 17.85 7.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 60.02 110.849 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -132.46 -38.43 1.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 70.24 110.961 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.0 t -104.49 104.55 17.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.075 -0.511 . . . . 72.01 111.109 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -98.78 146.02 26.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.18 -0.463 . . . . 75.2 110.95 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -116.71 178.25 4.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 73.15 110.895 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.5 -15.87 17.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.173 -0.467 . . . . 74.2 110.905 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -165.81 171.89 12.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.474 . . . . 74.21 110.869 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.589 ' HG ' HD21 ' A' ' 138' ' ' LEU . 0.6 OUTLIER -75.05 -22.8 58.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 73.34 110.909 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -56.76 13.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 74.25 110.875 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -65.86 -35.2 79.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.278 -0.419 . . . . 53.54 110.913 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.35 -52.69 62.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.251 -0.431 . . . . 61.5 110.975 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.488 HG13 ' CD1' ' A' ' 167' ' ' LEU . 75.0 t -62.67 -36.61 76.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.24 -0.436 . . . . 73.13 111.126 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -55.02 -39.29 68.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.117 -0.492 . . . . 74.34 110.887 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.97 -45.99 58.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 74.34 110.887 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.424 ' CD1' HD13 ' A' ' 163' ' ' LEU . 36.2 m-85 -65.63 -23.68 66.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 64.21 110.99 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 87.3 m -84.14 -28.94 27.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.096 -0.502 . . . . 74.41 111.131 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 29.1 m -77.67 -26.21 50.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.279 -0.419 . . . . 61.13 111.163 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -165.03 162.85 20.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 71.34 110.892 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.99 -58.4 6.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 52.21 111.126 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 32.0 t70 57.93 21.69 7.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 72.41 110.876 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 113.27 7.33 21.11 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.803 -0.713 . . . . 44.44 112.518 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.424 HD13 ' CD1' ' A' ' 156' ' ' TYR . 7.8 mp -100.66 138.92 37.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.787 0.327 . . . . 73.41 110.959 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 36.1 t -51.35 -30.8 19.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 41.31 110.889 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 9.5 t -158.47 126.17 5.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 74.24 111.184 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -51.69 152.41 2.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 71.43 110.823 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.488 ' CD1' HG13 ' A' ' 153' ' ' VAL . 9.9 mt -74.33 139.04 43.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 63.02 110.847 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.638 HD12 ' O ' ' A' ' 101' ' ' THR . 26.1 mt -127.14 -51.18 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 65.11 111.124 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . 0.408 ' O ' HD12 ' A' ' 103' ' ' LEU . 4.1 mtmt -130.19 119.44 18.69 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.596 0.712 . . . . 73.43 110.831 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 140.76 43.39 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.716 2.277 . . . . 72.32 112.287 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . 0.453 ' HE3' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -69.65 83.76 0.44 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.163 -0.472 . . . . 64.01 110.899 179.895 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 30.2 m -64.45 126.28 22.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 74.31 111.154 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 4.4 mtm . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 61.21 110.894 179.949 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 CA-C-O 121.438 0.466 . . . . 75.23 112.46 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 168.9 20.23 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.674 2.249 . . . . 72.13 112.341 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.07 -35.45 66.98 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.23 -0.441 . . . . 72.33 110.85 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 96.92 29.16 8.24 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.802 -0.713 . . . . 72.51 112.511 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 63.0 p -82.3 141.9 32.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.873 0.368 . . . . 65.55 110.949 -179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -78.18 105.17 9.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 53.13 110.891 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -179.38 124.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 74.31 110.879 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -114.05 -176.42 2.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.448 . . . . 75.14 110.905 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 3.0 p 178.79 93.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.109 -0.496 . . . . 55.14 110.898 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -168.06 97.16 0.44 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 60.25 110.774 -179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.587 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER -164.41 88.57 0.5 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.474 . . . . 63.15 110.895 179.939 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.74 91.07 8.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 72.3 110.865 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 59.7 t80 -79.85 149.59 30.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 73.43 110.907 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -144.34 129.18 18.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.067 -0.515 . . . . 72.33 110.944 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . 0.601 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -94.89 158.37 15.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 74.51 110.905 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -62.75 -16.64 58.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.181 -0.463 . . . . 74.2 110.871 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -39.28 90.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 71.25 110.852 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -90.61 -25.38 20.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 64.13 110.812 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.494 ' HB2' HD11 ' B' ' 305' ' ' LEU . 12.5 m-20 -147.03 84.97 7.14 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.627 0.727 . . . . 72.54 110.882 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.76 -6.6 19.0 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.699 2.266 . . . . 75.15 112.367 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 12.2 t -94.39 27.36 2.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 74.22 111.149 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.643 HD13 ' OE2' ' B' ' 309' ' ' GLU . 57.3 mt -101.11 136.83 40.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 72.22 110.879 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.461 HG23 ' H ' ' B' ' 309' ' ' GLU . 10.1 t -92.02 152.89 19.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 73.25 111.116 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -49.89 -31.2 11.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 75.54 110.895 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -54.07 50.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 74.41 110.865 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.643 ' OE2' HD13 ' B' ' 305' ' ' LEU . 0.3 OUTLIER -58.92 -32.45 69.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 64.11 110.91 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.43 HD12 ' CG ' ' A' ' 111' ' ' ASN . 30.5 mm -62.08 -53.67 44.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.152 -0.476 . . . . 53.13 111.076 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 1.1 p -56.9 -30.78 64.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 71.43 110.926 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -64.39 -15.14 59.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.513 . . . . 60.32 111.108 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . 0.408 ' HE2' ' HA ' ' B' ' 310' ' ' ILE . 1.6 mtm -104.94 8.0 34.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 74.2 110.925 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.483 ' HE1' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -96.35 -35.57 11.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.102 -1.408 . . . . 63.12 110.829 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.3 156.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 72.34 110.837 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.471 HG21 ' HA ' ' A' ' 141' ' ' ASP . 5.7 m -51.41 130.09 11.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.06 -0.518 . . . . 60.22 111.138 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -145.76 75.01 1.41 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.192 -0.458 . . . . 72.43 110.891 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.08 160.14 1.28 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.593 0.711 . . . . 73.42 110.879 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 111.59 2.86 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.694 2.263 . . . . 62.14 112.352 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 CA-C-O 119.158 -0.801 . . . . 72.25 112.502 -179.994 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 CA-C-O 121.41 0.45 . . . . 74.22 112.484 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 -8.18 22.96 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.68 2.253 . . . . 72.32 112.324 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 63.81 23.04 13.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 72.3 110.884 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.1 -67.19 1.95 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.694 -0.765 . . . . 71.24 112.5 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 7.7 p -142.48 30.27 1.54 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.895 0.378 . . . . 71.54 110.912 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -148.82 75.62 9.95 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.588 0.708 . . . . 71.43 110.822 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.74 -25.55 28.58 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.661 2.241 . . . . 53.23 112.406 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.466 ' HZ3' HG21 ' A' ' 106' ' ' VAL . 47.6 p-90 -54.83 -25.75 30.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 71.34 110.919 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -90.66 99.26 12.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 74.14 110.899 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -75.96 -41.99 49.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.106 -0.497 . . . . 74.33 110.906 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.54 25.39 55.17 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.731 -0.747 . . . . 72.03 112.541 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.4 65.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 63.21 110.875 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.617 HG23 ' HB3' ' A' ' 91' ' ' GLN . 26.8 mm -136.06 145.25 31.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 73.1 111.084 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.9 p -97.48 177.09 5.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 73.24 111.15 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -65.98 -39.46 90.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 73.15 110.822 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.92 -37.63 88.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.261 -0.427 . . . . 71.32 110.897 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.617 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -76.01 -37.83 58.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.088 -0.506 . . . . 73.53 110.904 -179.865 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.57 -33.98 67.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 65.2 111.118 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -67.14 -53.14 33.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 62.31 110.886 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.47 -40.06 94.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 72.1 110.896 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.6 mt -56.41 -38.85 72.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 73.22 110.95 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.675 HD12 ' CB ' ' A' ' 121' ' ' SER . 3.5 mm? -99.48 43.26 1.07 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 63.14 110.902 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -69.11 -60.04 4.62 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.717 0.77 . . . . 71.31 110.891 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.5 Cg_endo -69.79 123.99 10.63 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.728 2.286 . . . . 64.35 112.315 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.65 117.69 5.23 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.706 2.27 . . . . 73.41 112.38 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -155.12 103.67 2.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.439 . . . . 71.13 110.841 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.657 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -57.33 111.83 1.21 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 72.53 111.116 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.34 -8.92 5.93 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.761 -0.733 . . . . 32.13 112.523 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.6 tp -88.07 111.89 22.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.891 0.377 . . . . 71.21 110.875 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.453 ' HB2' HD11 ' A' ' 118' ' ' LEU . 25.7 p90 -123.54 165.31 17.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 74.43 110.888 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.624 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -161.58 137.34 7.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.478 . . . . 61.22 110.883 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.466 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 91.1 t -109.52 129.91 63.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.221 -0.445 . . . . 51.41 111.15 179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.91 137.93 29.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 71.04 110.946 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.4 126.96 18.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.45 . . . . 73.15 110.935 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.0 m -55.57 114.01 1.68 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 73.32 110.794 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 25.9 m -70.07 -49.16 53.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.135 -0.484 . . . . 64.34 111.098 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.405 ' ND2' HD12 ' B' ' 310' ' ' ILE . 16.7 p30 -80.16 -3.17 47.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.44 . . . . 71.51 110.932 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -139.48 88.6 12.52 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.615 0.721 . . . . 72.13 110.897 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 122.29 8.98 Favored 'Trans proline' 0 C--N 1.34 0.117 0 C-N-CA 122.679 2.252 . . . . 70.22 112.341 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.87 -8.21 23.62 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.714 -0.755 . . . . 54.53 112.567 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -127.94 -179.64 5.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.759 0.314 . . . . 65.3 110.9 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -130.86 164.33 25.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 73.24 110.94 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.435 HG23 ' HE2' ' B' ' 314' ' ' PTR . 97.3 m -143.87 128.16 17.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 72.15 111.138 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.453 HD11 ' HB2' ' A' ' 104' ' ' PHE . 0.3 OUTLIER -97.31 132.75 42.74 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.272 -0.422 . . . . 42.44 110.917 179.909 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 5.8 m -113.02 126.54 55.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.166 -0.47 . . . . 74.44 110.908 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 14.3 t -126.61 152.37 34.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 53.33 111.116 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.675 ' CB ' HD12 ' A' ' 96' ' ' LEU . 0.4 OUTLIER -104.66 111.9 24.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 60.21 110.87 -179.877 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -115.26 93.04 4.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.147 -0.479 . . . . 25.05 110.911 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 66.68 31.03 7.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 73.2 110.887 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.31 -12.87 65.0 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.79 -0.719 . . . . 44.1 112.491 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.18 139.91 30.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.805 0.336 . . . . 73.52 110.906 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.528 ' O ' HD13 ' B' ' 294' ' ' LEU . 92.6 t -99.93 111.21 28.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.24 -0.436 . . . . 65.24 111.21 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -102.89 129.9 49.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 74.1 110.866 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -105.36 127.28 52.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 74.5 110.824 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.63 ' CZ ' HD13 ' A' ' 163' ' ' LEU . 44.7 m-85 -113.71 111.11 21.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.29 -0.414 . . . . 61.02 110.93 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -63.32 137.16 58.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.066 -0.516 . . . . 65.31 110.841 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.468 ' CG2' HD23 ' A' ' 138' ' ' LEU . 54.3 mt -119.66 109.43 26.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.139 -0.482 . . . . 73.42 111.132 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -84.63 121.4 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 72.34 110.954 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.476 ' CE2' HD21 ' A' ' 138' ' ' LEU . 0.2 OUTLIER -110.5 98.11 7.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.327 -0.397 . . . . 71.05 111.013 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -132.03 142.65 49.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.463 . . . . 62.1 110.844 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 56.55 35.95 26.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.47 . . . . 40.25 111.165 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 12.5 t 61.31 30.12 18.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.202 -0.454 . . . . 65.42 110.812 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -135.57 143.56 45.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.466 . . . . 75.24 110.942 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.476 HD21 ' CE2' ' A' ' 133' ' ' TYR . 4.0 mp -106.37 149.8 26.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 63.32 110.966 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.27 140.82 5.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 60.0 110.836 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.479 HG22 HG13 ' B' ' 317' ' ' VAL . 49.8 mt -115.61 -34.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 72.21 111.148 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.716 ' CB ' HG21 ' B' ' 317' ' ' VAL . 31.6 p-10 -96.65 11.53 35.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 71.24 110.875 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.424 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 6.6 pt-20 45.76 30.73 0.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 74.1 110.898 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -131.88 -39.96 1.08 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.112 -0.494 . . . . 70.42 110.906 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 144' ' ' VAL . 2.6 p -116.6 104.51 16.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 61.35 111.087 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -93.0 148.91 21.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 75.21 110.957 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 45.4 m-85 -119.4 177.71 4.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 54.23 110.821 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -100.52 -15.52 17.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 53.34 110.919 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -165.81 172.12 12.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 64.31 110.883 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -22.57 59.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 63.11 110.912 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 7.2 ttp -62.73 -57.0 12.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.471 . . . . 75.51 110.84 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -66.17 -35.56 80.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 73.32 110.948 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.45 -49.9 71.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 74.45 110.923 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.722 HG13 HD12 ' A' ' 167' ' ' LEU . 73.8 t -64.01 -38.19 81.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.183 -0.462 . . . . 54.05 111.192 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -54.84 -38.17 67.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.11 -0.495 . . . . 62.14 110.926 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.24 -46.1 57.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.133 -0.485 . . . . 71.53 110.888 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.414 ' CD1' HD23 ' A' ' 163' ' ' LEU . 35.6 m-85 -70.86 -11.28 60.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.217 -0.447 . . . . 73.33 110.938 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.4 m -92.2 -32.43 15.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.105 -0.498 . . . . 62.44 111.128 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 5.7 t -80.35 -25.64 39.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.304 -0.407 . . . . 71.51 111.078 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -157.53 158.06 34.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.304 -0.407 . . . . 75.34 110.853 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.89 -56.48 12.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 72.43 111.103 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 58.12 22.63 9.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 74.41 110.846 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 111.28 11.17 18.65 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.752 . . . . 62.44 112.466 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.63 HD13 ' CZ ' ' A' ' 129' ' ' TYR . 3.1 mm? -105.62 134.5 48.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.928 0.394 . . . . 72.23 110.943 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 23.5 t -51.71 -29.71 19.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.148 -0.478 . . . . 63.5 110.849 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.4 ' HB ' HG22 ' A' ' 101' ' ' THR . 3.0 t -153.03 120.44 5.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 70.5 111.116 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -53.54 143.0 20.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 73.5 110.913 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.722 HD12 HG13 ' A' ' 153' ' ' VAL . 7.7 mt -61.56 135.58 57.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 44.42 110.888 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.657 HD12 ' O ' ' A' ' 101' ' ' THR . 27.0 mt -127.19 -51.41 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 64.43 111.117 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.4 120.04 22.01 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.605 0.717 . . . . 73.44 110.841 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 133.83 26.48 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.699 2.266 . . . . 73.42 112.302 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.94 83.67 0.49 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 61.4 110.883 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.8 m -64.55 144.97 14.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.251 -0.431 . . . . 61.32 111.173 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 7.8 ptm . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 71.34 110.886 179.92 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.269 0 CA-C-O 121.505 0.503 . . . . 72.0 112.455 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 169.65 18.42 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.683 2.255 . . . . 53.2 112.383 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 6.5 mt -53.54 -46.93 70.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 74.5 110.859 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 108.15 -21.48 29.05 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.781 -0.724 . . . . 61.25 112.487 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 1.5 m -147.4 89.81 1.81 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.948 0.404 . . . . 73.41 110.838 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.76 100.79 1.62 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.09 -0.504 . . . . 50.34 110.856 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -172.19 170.86 5.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 75.31 110.887 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -159.57 64.92 0.37 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 73.35 110.932 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 10.3 p -176.42 79.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.091 -0.504 . . . . 71.14 110.863 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 33.3 t -130.26 109.19 10.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 62.11 110.899 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.1 OUTLIER -164.07 110.74 1.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 34.44 110.915 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 3.3 t -110.17 88.4 2.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 75.35 110.883 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -83.46 149.43 26.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.211 -0.45 . . . . 65.43 110.975 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.71 129.39 10.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 75.54 110.891 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.25 170.89 9.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.209 -0.45 . . . . 55.13 110.888 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -63.8 -15.58 59.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 72.31 110.914 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.47 -38.58 91.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 73.34 110.848 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -104.08 -26.14 12.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.876 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.515 ' HB2' HD11 ' B' ' 305' ' ' LEU . 31.0 m-20 -138.33 77.8 34.68 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.594 0.712 . . . . 64.32 110.897 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.73 -6.15 17.89 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.674 2.249 . . . . 64.12 112.308 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.3 t -93.64 27.27 2.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.434 . . . . 75.42 111.069 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.515 HD11 ' HB2' ' B' ' 302' ' ' ASP . 36.0 mt -103.11 136.65 42.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.269 -0.423 . . . . 72.5 110.997 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.65 HG22 ' HG2' ' B' ' 309' ' ' GLU . 11.7 t -107.12 173.69 6.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.235 -0.438 . . . . 72.34 111.171 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 26.8 pt-20 -49.26 -37.63 24.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 72.32 110.793 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -61.38 -52.0 66.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 74.31 110.916 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.65 ' HG2' HG22 ' B' ' 306' ' ' THR . 9.1 mm-40 -63.29 -52.45 61.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 53.2 110.878 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.604 HG22 ' HE1' ' B' ' 314' ' ' PTR . 46.2 mm -56.33 -54.06 32.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.468 . . . . 43.13 111.098 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 22.8 t -60.33 -19.92 57.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 75.31 110.882 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -82.0 3.0 28.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.092 -0.504 . . . . 43.25 111.102 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . 0.447 ' CE ' HD13 ' B' ' 310' ' ' ILE . 1.8 mtm -115.49 14.46 16.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 61.54 110.887 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.604 ' HE1' HG22 ' B' ' 310' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 16.2 t -105.73 -39.2 6.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.084 -1.417 . . . . 74.12 110.838 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 66.44 139.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.475 . . . . 63.33 110.87 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.716 HG21 ' CB ' ' A' ' 141' ' ' ASP . 5.6 m -50.93 122.24 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 73.42 111.188 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -131.85 80.88 1.94 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.932 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt -58.62 160.41 10.29 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.599 0.714 . . . . 71.53 110.917 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 111.53 2.84 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.707 2.272 . . . . 63.43 112.351 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 CA-C-O 119.14 -0.811 . . . . 33.1 112.472 179.978 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 CA-C-O 121.44 0.467 . . . . 63.21 112.494 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -32.04 19.1 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.698 2.265 . . . . 71.43 112.304 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.26 25.76 11.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 62.33 110.868 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.17 -55.15 25.55 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.73 -0.747 . . . . 55.4 112.536 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 25.1 t -118.74 28.91 8.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.898 0.38 . . . . 72.11 110.856 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.13 74.35 5.53 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.571 0.7 . . . . 73.52 110.824 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.84 -25.34 28.35 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.632 2.221 . . . . 73.31 112.324 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.452 ' CH2' HG21 ' A' ' 153' ' ' VAL . 47.1 p-90 -54.54 -27.18 36.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.251 -0.431 . . . . 73.04 110.899 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -87.45 99.48 12.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 64.41 110.997 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -75.6 -39.62 57.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.16 -0.473 . . . . 75.3 110.914 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.65 23.91 38.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.788 -0.72 . . . . 71.0 112.557 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.53 70.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.798 0.332 . . . . 73.31 110.913 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.626 HG23 ' HB3' ' A' ' 91' ' ' GLN . 26.4 mm -138.95 145.14 28.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.266 -0.425 . . . . 74.31 111.152 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.7 p -97.4 177.17 5.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.21 -0.45 . . . . 64.22 111.154 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -39.33 89.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.221 -0.445 . . . . 73.35 110.919 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -64.04 -37.54 87.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 71.22 110.884 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.626 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -76.13 -38.57 56.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 75.13 110.94 -179.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.27 -36.45 79.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 71.13 111.044 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -67.61 -53.15 30.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 73.04 110.88 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.99 -34.51 78.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 73.14 110.876 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.29 -35.69 81.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 73.25 110.89 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.618 HD12 ' HB3' ' A' ' 121' ' ' SER . 2.4 mm? -104.89 43.74 1.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 73.51 110.91 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -68.45 -59.94 5.37 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.604 0.716 . . . . 72.01 110.919 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.0 Cg_endo -69.81 122.66 9.32 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.647 2.232 . . . . 72.33 112.307 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 117.61 5.19 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.66 2.24 . . . . 63.21 112.369 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -154.99 103.48 2.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.196 -0.456 . . . . 75.32 110.938 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.681 ' O ' HD12 ' A' ' 168' ' ' ILE . 10.8 p -56.14 111.93 1.08 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.456 . . . . 54.33 111.186 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 130.54 -10.8 5.79 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.77 -0.728 . . . . 63.23 112.546 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.5 tp -87.8 111.83 21.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.79 0.329 . . . . 74.5 110.923 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.454 ' HB3' HD22 ' A' ' 167' ' ' LEU . 23.4 p90 -123.79 162.09 23.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 73.23 110.889 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.559 HD23 HD21 ' A' ' 96' ' ' LEU . 0.8 OUTLIER -157.65 136.58 11.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.117 -0.492 . . . . 74.34 110.985 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.442 HG21 ' HZ3' ' A' ' 82' ' ' TRP . 88.6 t -109.6 139.54 32.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.429 . . . . 65.24 111.23 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.417 ' NH2' HG21 ' A' ' 117' ' ' THR . 0.0 OUTLIER -151.91 144.55 24.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 62.11 110.805 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.74 124.05 10.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 41.53 110.926 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.3 m -59.47 118.75 6.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 65.25 110.941 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.643 HG21 ' HB2' ' B' ' 298' ' ' SER . 3.8 m -68.65 -56.38 8.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 75.02 111.215 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.545 ' CG ' HD12 ' B' ' 310' ' ' ILE . 1.2 m-80 -70.49 -29.21 65.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 70.42 110.915 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -107.88 92.72 9.42 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.665 0.745 . . . . 73.35 110.878 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 112.94 3.22 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.612 2.208 . . . . 62.31 112.399 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.54 -4.84 24.72 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.699 -0.763 . . . . 64.23 112.499 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -121.17 -178.9 3.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.824 0.345 . . . . 72.23 110.857 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . 0.512 ' HB2' HD12 ' A' ' 131' ' ' ILE . 60.0 m-85 -125.52 171.5 10.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.431 . . . . 73.14 110.94 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.693 HG23 ' HE1' ' B' ' 314' ' ' PTR . 99.2 m -139.42 122.82 17.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 52.04 111.126 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.43 112.49 25.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 72.33 110.89 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 42.9 t -101.33 124.14 46.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 65.33 110.879 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 17.8 t -121.75 150.21 25.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 72.45 111.115 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . 0.618 ' HB3' HD12 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -98.25 110.82 23.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 72.31 110.895 -179.832 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.04 90.35 3.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.127 -0.488 . . . . 64.43 110.937 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 66.1 32.78 7.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 74.32 110.856 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.48 -13.8 63.93 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.758 -0.734 . . . . 72.51 112.507 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt -87.89 146.39 25.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.835 0.35 . . . . 55.12 110.9 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.658 ' O ' HD13 ' B' ' 294' ' ' LEU . 5.8 m -106.53 104.13 16.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.216 -0.447 . . . . 73.01 111.13 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -89.47 112.69 23.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 72.43 110.884 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -92.6 124.85 36.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 73.1 110.846 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.442 ' HB3' HD13 ' A' ' 140' ' ' ILE . 80.4 m-85 -118.36 106.71 13.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 73.33 110.93 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 6.7 ttp-105 -70.23 136.77 50.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.056 -0.52 . . . . 61.13 110.863 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.512 HD12 ' HB2' ' A' ' 116' ' ' TYR . 58.2 mt -110.83 108.42 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.188 -0.46 . . . . 75.5 111.153 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.65 124.79 26.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 64.41 110.937 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.462 ' CD2' HD21 ' A' ' 138' ' ' LEU . 0.1 OUTLIER -109.53 104.52 13.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 72.33 110.951 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -144.26 143.25 30.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.152 -0.477 . . . . 73.11 110.913 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 60.39 39.93 18.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 63.22 111.128 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 56.87 24.09 8.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.254 -0.43 . . . . 72.43 110.843 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 7.3 mtmm -131.47 162.94 29.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.135 -0.484 . . . . 74.23 110.917 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.462 HD21 ' CD2' ' A' ' 133' ' ' TYR . 1.1 mt -124.52 148.57 47.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.214 -0.448 . . . . 75.04 110.943 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 7.2 t -166.44 145.75 5.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 64.33 110.908 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.55 HG22 HG13 ' B' ' 317' ' ' VAL . 56.1 mt -115.58 -28.75 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 73.31 111.123 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.622 ' HB3' HG21 ' B' ' 317' ' ' VAL . 4.3 p30 -101.25 12.76 36.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 73.04 110.906 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.441 ' CG ' ' O ' ' A' ' 141' ' ' ASP . 7.1 pt-20 46.9 27.93 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.177 -0.465 . . . . 71.31 110.906 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -133.12 -37.77 0.97 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.121 -0.49 . . . . 65.15 110.899 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 1.4 t -110.65 104.64 17.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.092 -0.503 . . . . 74.13 111.077 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -97.56 138.05 35.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 72.44 110.97 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.575 ' CD1' HD12 ' A' ' 152' ' ' LEU . 43.8 m-85 -114.43 176.52 5.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 72.01 110.909 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.58 -14.58 18.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 55.03 110.904 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -165.51 172.18 12.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 72.11 110.899 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.614 HD13 HD22 ' A' ' 152' ' ' LEU . 0.1 OUTLIER -74.63 -22.4 58.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 73.12 110.91 179.988 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -62.73 -57.12 12.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.443 . . . . 65.5 110.896 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -65.53 -36.3 83.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.239 -0.437 . . . . 62.13 110.976 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.614 HD22 HD13 ' A' ' 149' ' ' LEU . 0.9 OUTLIER -55.21 -53.22 58.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 63.23 110.932 179.973 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.558 HG13 HD12 ' A' ' 167' ' ' LEU . 67.2 t -60.77 -37.52 76.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 75.25 111.11 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -55.06 -39.02 68.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 74.32 110.832 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -71.78 -46.54 57.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 75.21 110.884 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.434 ' CD1' HD13 ' A' ' 163' ' ' LEU . 39.1 m-85 -66.37 -21.23 66.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 75.12 110.885 -179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 92.0 m -84.18 -31.28 25.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 73.13 111.131 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 61.7 m -78.29 -24.42 46.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 74.4 111.137 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -165.64 157.84 14.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 74.01 110.885 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 163' ' ' LEU . . . -51.26 -58.26 6.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 70.31 111.089 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 53.92 27.54 7.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 71.51 110.855 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 118.88 3.99 13.13 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.75 -0.738 . . . . 53.41 112.509 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.464 ' O ' ' HB1' ' A' ' 160' ' ' ALA . 9.5 mp -106.67 140.95 38.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 73.14 110.871 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . 0.436 ' SG ' HG22 ' A' ' 165' ' ' THR . 18.2 p -54.44 -26.38 30.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 51.0 110.885 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.436 HG22 ' SG ' ' A' ' 164' ' ' CYS . 9.0 t -162.64 129.55 3.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 74.41 111.105 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -53.13 161.39 0.86 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 71.44 110.777 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.558 HD12 HG13 ' A' ' 153' ' ' VAL . 10.4 mt -79.21 141.41 37.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 65.42 110.886 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.681 HD12 ' O ' ' A' ' 101' ' ' THR . 23.1 mt -127.18 -51.4 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 75.21 111.167 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.6 mtpt -130.13 123.18 20.59 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.577 0.703 . . . . 73.34 110.937 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 138.3 37.6 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.721 2.281 . . . . 61.55 112.303 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.1 83.62 0.52 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.229 -0.441 . . . . 73.12 110.931 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 21.1 t -64.2 136.9 25.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 72.2 111.089 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 1.6 ptt? . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 75.35 110.87 179.888 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.236 0 CA-C-O 121.424 0.458 . . . . 52.14 112.455 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 166.15 28.54 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.739 2.293 . . . . 65.25 112.296 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 9.5 mp -58.67 -29.83 66.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 75.34 110.907 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 65.75 24.78 71.49 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.727 -0.749 . . . . 74.22 112.488 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 1.2 m -68.22 102.59 1.39 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.906 0.384 . . . . 51.24 110.903 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.92 120.01 9.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 74.25 110.796 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -174.07 142.34 0.83 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 74.35 110.878 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -128.54 67.75 1.38 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 75.54 110.917 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.0 86.33 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.501 . . . . 53.42 110.866 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 21.5 t -139.89 110.56 6.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.071 -0.513 . . . . 43.33 110.834 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.658 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.2 OUTLIER -163.8 103.8 0.91 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.155 -0.475 . . . . 72.42 110.918 -179.95 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 6.0 t -102.65 88.83 3.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 74.44 110.852 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -83.75 147.82 27.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.109 -0.496 . . . . 74.12 110.942 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -145.56 129.14 17.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.071 -0.513 . . . . 74.12 110.858 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . 0.643 ' HB2' HG21 ' A' ' 110' ' ' THR . 0.0 OUTLIER -88.52 162.16 16.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 42.15 110.917 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 62.1 mtt180 -62.2 -16.89 56.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 74.14 110.838 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.9 -36.88 84.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.244 -0.434 . . . . 72.04 110.882 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -98.32 -19.98 17.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.489 . . . . 63.54 110.87 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.513 ' HB2' HD11 ' B' ' 305' ' ' LEU . 53.1 m-20 -149.39 79.73 8.02 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.559 0.695 . . . . 63.54 110.791 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 -6.6 18.98 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.754 2.303 . . . . 71.23 112.315 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 11.6 t -94.11 27.27 2.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.233 -0.44 . . . . 64.51 111.102 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.513 HD11 ' HB2' ' B' ' 302' ' ' ASP . 48.6 mt -100.24 136.92 39.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.225 -0.443 . . . . 62.53 110.933 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.618 HG22 ' HG2' ' B' ' 309' ' ' GLU . 12.0 t -107.75 174.53 5.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 61.52 111.133 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -50.07 -37.86 35.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.212 -0.449 . . . . 75.21 110.84 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -60.95 -49.71 76.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 74.54 110.925 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.618 ' HG2' HG22 ' B' ' 306' ' ' THR . 20.9 mm-40 -66.69 -51.95 50.25 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.159 -0.473 . . . . 73.41 110.945 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.545 HD12 ' CG ' ' A' ' 111' ' ' ASN . 44.6 mm -56.05 -53.75 35.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.119 -0.491 . . . . 64.1 111.094 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 82.8 p -59.8 -25.24 64.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 74.31 110.806 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . . . . . . . . . . . -77.98 -2.66 38.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.48 . . . . 74.2 111.071 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.09 -3.2 23.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 70.0 110.895 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.693 ' HE1' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.1 -32.43 10.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.159 -1.382 . . . . 73.11 110.871 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.29 155.65 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 74.42 110.865 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.622 HG21 ' HB3' ' A' ' 141' ' ' ASP . 4.7 m -51.38 121.31 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 65.42 111.13 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -135.92 74.96 1.53 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 52.42 110.797 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 22.1 mttt -55.34 160.54 3.47 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.63 0.729 . . . . 62.04 110.875 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.66 112.74 3.14 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.735 2.29 . . . . 75.31 112.392 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.364 0 CA-C-O 119.084 -0.842 . . . . 75.32 112.471 179.988 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 CA-C-O 121.444 0.469 . . . . 62.41 112.497 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.69 -8.1 22.72 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.703 2.269 . . . . 74.1 112.323 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.9 25.4 13.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.259 -0.428 . . . . 75.34 110.915 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.0 -47.95 17.43 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.749 -0.739 . . . . 44.11 112.442 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 5.5 m -165.98 49.6 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.859 0.362 . . . . 70.44 110.872 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.2 mtt -138.19 74.79 41.7 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.531 0.681 . . . . 72.22 110.842 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.68 -8.2 23.0 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.717 2.278 . . . . 64.23 112.348 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.487 ' CH2' HG21 ' A' ' 153' ' ' VAL . 45.0 p-90 -100.09 -28.25 13.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.267 -0.424 . . . . 75.33 110.902 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -83.55 102.19 11.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.418 . . . . 74.23 110.888 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -75.57 -38.65 59.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 64.23 110.818 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 59.27 18.14 41.38 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.719 -0.753 . . . . 72.23 112.494 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.96 80.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.68 0.276 . . . . 72.52 110.871 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.595 HG23 ' HB3' ' A' ' 91' ' ' GLN . 26.5 mm -145.82 145.41 20.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.321 -0.399 . . . . 74.52 111.181 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.3 p -100.21 176.85 5.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 72.02 111.156 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -43.29 97.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.22 -0.446 . . . . 71.21 110.865 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.31 -37.74 78.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 73.21 110.871 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.595 ' HB3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -76.51 -38.24 55.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 73.03 110.847 -179.923 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.21 -38.47 85.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.256 -0.429 . . . . 63.42 111.106 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.88 -52.45 50.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 72.33 110.858 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.6 -33.64 76.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 74.24 110.862 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 11.7 mt -60.74 -38.0 83.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 74.34 110.92 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.617 ' CD1' HD23 ' A' ' 105' ' ' LEU . 8.1 mp -105.77 43.18 1.15 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 71.42 110.891 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.497 ' N ' ' HD2' ' A' ' 98' ' ' PRO . 0.1 OUTLIER -61.39 -59.83 12.37 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.649 0.738 . . . . 74.42 110.917 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 97' ' ' TYR . 53.6 Cg_endo -69.77 124.2 10.85 Favored 'Trans proline' 0 C--O 1.233 0.228 0 C-N-CA 122.695 2.263 . . . . 74.33 112.355 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.79 111.06 2.71 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.694 2.263 . . . . 75.03 112.273 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -148.99 123.28 9.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 64.43 110.954 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.687 ' O ' HD12 ' A' ' 168' ' ' ILE . 0.5 OUTLIER -72.97 111.66 8.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 63.03 111.174 -179.897 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.79 -7.81 6.13 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.786 -0.721 . . . . 63.43 112.47 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.4 tp -87.4 111.63 21.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.852 0.358 . . . . 62.32 110.98 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -125.33 160.17 29.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 74.4 110.839 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.617 HD23 ' CD1' ' A' ' 96' ' ' LEU . 1.1 pp -156.09 134.71 11.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.112 -0.495 . . . . 73.32 110.92 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.518 HG22 HD12 ' A' ' 118' ' ' LEU . 91.9 t -109.52 141.22 25.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.171 -0.468 . . . . 53.41 111.101 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -153.58 149.94 28.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.156 -0.474 . . . . 73.53 110.826 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -50.81 124.28 10.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.917 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.6 t -57.32 104.93 0.19 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.123 -0.49 . . . . 61.01 110.817 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 7.7 m -68.68 -30.04 68.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 50.23 111.083 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.656 HD22 HD12 ' B' ' 310' ' ' ILE . 0.1 OUTLIER -74.93 -30.55 61.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 61.35 110.928 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -139.64 116.09 8.3 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.636 0.731 . . . . 75.25 110.895 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 122.17 8.86 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.676 2.25 . . . . 62.13 112.349 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 113.4 -9.73 24.27 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.708 -0.758 . . . . 55.33 112.54 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -114.53 175.47 5.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.341 . . . . 62.22 110.871 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -132.57 146.55 51.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 73.33 110.911 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.445 HG23 ' HE1' ' B' ' 314' ' ' PTR . 3.3 m -116.71 138.84 51.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 74.12 111.097 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.518 HD12 HG22 ' A' ' 106' ' ' VAL . 0.8 OUTLIER -112.82 115.93 29.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.48 . . . . 73.32 110.919 179.954 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 8.4 m -99.87 120.17 39.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.261 -0.427 . . . . 53.25 110.875 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.4 t -121.99 146.97 26.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 65.32 111.174 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.43 110.45 22.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.229 -0.442 . . . . 75.13 110.794 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.0 t -118.1 98.05 6.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.092 -0.504 . . . . 75.44 110.904 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 66.22 28.29 10.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 75.01 110.86 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 97.35 -14.91 63.0 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.77 -0.729 . . . . 44.43 112.512 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 7.5 ptpt -87.58 139.03 30.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.342 . . . . 75.21 110.986 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.589 ' O ' HD13 ' B' ' 294' ' ' LEU . 11.0 m -99.67 109.68 25.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 71.22 111.124 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -100.98 130.74 47.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 74.33 110.826 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -105.9 131.47 53.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 72.05 110.852 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . 0.598 ' HB3' HD13 ' A' ' 140' ' ' ILE . 80.2 m-85 -115.94 115.74 26.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 73.13 110.892 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -70.55 125.29 26.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.52 . . . . 71.41 110.865 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.467 HG12 HD11 ' A' ' 140' ' ' ILE . 79.6 mt -107.07 108.9 26.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 60.41 111.172 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' MET . . . . . . . . . . . . . 4.2 ttt -76.27 129.44 36.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.111 -0.495 . . . . 73.2 110.792 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -111.89 116.65 30.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 74.13 110.926 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -151.11 135.99 17.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.488 . . . . 72.5 110.846 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 54.02 35.89 23.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.52 111.126 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.5 27.16 15.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.17 -0.468 . . . . 70.34 110.873 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.73 136.07 51.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.098 -0.501 . . . . 64.14 110.895 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.2 mp -101.52 150.15 23.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.174 -0.466 . . . . 74.1 110.89 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 53.3 p -167.95 131.81 1.68 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 73.24 110.895 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.598 HD13 ' HB3' ' A' ' 129' ' ' TYR . 60.7 mt -105.8 -33.5 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 53.34 111.117 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -85.24 -0.36 54.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.464 . . . . 64.32 110.869 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 60.53 17.72 7.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 62.51 110.889 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -132.53 -38.55 1.03 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 43.14 110.932 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 3.8 t -101.99 104.5 16.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.1 -0.5 . . . . 72.44 111.166 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -99.87 143.38 30.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 65.25 110.975 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.401 ' CE1' HD12 ' A' ' 152' ' ' LEU . 62.1 m-85 -115.82 174.56 5.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.128 -0.487 . . . . 71.31 110.909 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -100.87 -3.52 29.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 73.22 110.888 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -176.51 157.87 1.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 74.4 110.879 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 1.3 mp -59.18 -44.08 92.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 62.42 110.953 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -36.25 36.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 52.24 110.858 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -75.21 -45.49 40.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 75.23 110.941 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.401 HD12 ' CE1' ' A' ' 146' ' ' PHE . 0.4 OUTLIER -55.83 -42.52 75.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 61.53 110.961 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.516 HG13 HD12 ' A' ' 167' ' ' LEU . 75.5 t -66.6 -43.36 90.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 64.4 111.13 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -52.97 -37.34 61.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 62.52 110.915 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -72.3 -47.6 48.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 72.3 110.81 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.494 ' CD1' HD13 ' A' ' 163' ' ' LEU . 42.9 m-85 -68.35 -15.59 63.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 73.14 110.943 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 94.3 m -86.76 -33.98 19.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.079 -0.51 . . . . 71.54 111.135 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 3.9 m -78.08 -25.37 47.6 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 51.33 111.076 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -157.5 161.67 38.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.244 -0.434 . . . . 74.22 110.853 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -50.65 -54.49 22.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 61.31 111.092 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 59.81 20.46 9.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 64.15 110.868 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 109.18 12.19 20.53 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.713 -0.756 . . . . 53.44 112.397 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.494 HD13 ' CD1' ' A' ' 156' ' ' TYR . 8.3 mp -105.89 136.93 44.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.794 0.331 . . . . 75.34 110.965 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' CYS . . . . . . . . . . . . . 11.5 t -51.57 -29.69 18.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 72.54 110.812 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.527 ' HB ' HG22 ' A' ' 101' ' ' THR . 1.9 t -152.67 120.24 6.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 64.01 111.118 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 9.7 ptm180 -50.97 146.1 6.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.135 -0.484 . . . . 75.05 110.901 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.516 HD12 HG13 ' A' ' 153' ' ' VAL . 7.0 mt -63.48 132.17 50.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 71.23 110.898 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' ILE . . . . . 0.687 HD12 ' O ' ' A' ' 101' ' ' THR . 23.9 mt -126.97 -51.39 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 73.41 111.184 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.3 mttm -123.87 119.25 26.83 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.54 0.686 . . . . 74.13 110.843 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 134.78 28.89 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.742 2.295 . . . . 55.24 112.362 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.99 84.46 0.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 63.55 110.898 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.7 m -64.42 129.89 28.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.221 -0.445 . . . . 70.42 111.153 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 6.6 mtt . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.24 -0.436 . . . . 71.1 110.914 179.861 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 284' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 CA-C-O 121.419 0.455 . . . . 70.23 112.485 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 285' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.69 167.61 23.85 Favored 'Trans proline' 0 C--O 1.233 0.237 0 C-N-CA 122.726 2.284 . . . . 64.2 112.344 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . . . . . . . . . 26.0 mt -63.2 -27.98 69.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.242 -0.435 . . . . 62.3 110.924 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 287' ' ' GLY . . . . . . . . . . . . . . . 101.24 -39.87 2.61 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.813 -0.708 . . . . 52.42 112.482 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 288' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -141.98 148.24 38.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.009 0.433 . . . . 74.2 110.797 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 289' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -157.97 143.08 16.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.061 -0.518 . . . . 74.51 110.898 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 290' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.03 118.13 7.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 73.32 110.856 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 291' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -169.26 108.8 0.44 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.136 -0.483 . . . . 74.4 110.849 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 292' ' ' SER . . . . . . . . . . . . . 1.3 p -96.34 91.36 5.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 72.1 110.862 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 293' ' ' SER . . . . . . . . . . . . . 43.4 p -59.36 -175.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.176 -0.465 . . . . 71.53 110.816 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 294' ' ' LEU . . . . . 0.589 HD13 ' O ' ' A' ' 126' ' ' VAL . 0.4 OUTLIER -162.17 92.25 0.82 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 71.14 110.983 -179.974 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 6.2 t -82.95 89.07 6.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 70.14 110.868 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 296' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -79.95 148.42 31.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.157 -0.474 . . . . 75.21 110.917 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 297' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.21 128.53 13.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 73.1 110.935 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 298' ' ' SER . . . . . . . . . . . . . 20.3 m -89.57 162.14 15.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.292 -0.413 . . . . 62.13 110.888 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 299' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -59.33 -19.8 49.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 74.12 110.857 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 300' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -36.7 82.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 63.34 110.852 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 301' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -102.58 -10.56 19.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 63.11 110.933 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 302' ' ' ASP . . . . . 0.524 ' HB2' HD11 ' B' ' 305' ' ' LEU . 44.7 m-20 -157.58 78.6 3.56 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.662 0.744 . . . . 64.53 110.937 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 303' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.64 -6.7 19.17 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.77 2.314 . . . . 75.12 112.351 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 304' ' ' THR . . . . . . . . . . . . . 15.2 t -93.74 27.54 2.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.213 -0.449 . . . . 65.11 111.168 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 305' ' ' LEU . . . . . 0.524 HD11 ' HB2' ' B' ' 302' ' ' ASP . 44.0 mt -101.74 138.25 38.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 75.41 110.955 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 306' ' ' THR . . . . . 0.609 HG22 ' HG2' ' B' ' 309' ' ' GLU . 10.8 t -107.52 172.97 6.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 74.52 111.132 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 307' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -50.09 -31.98 14.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.451 . . . . 62.15 110.967 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 308' ' ' GLU . . . . . 0.462 ' H ' HG23 ' B' ' 306' ' ' THR . 0.6 OUTLIER -66.72 -45.8 77.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.099 -0.501 . . . . 44.45 110.87 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 309' ' ' GLU . . . . . 0.609 ' HG2' HG22 ' B' ' 306' ' ' THR . 19.3 mm-40 -70.31 -51.67 28.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 52.54 110.872 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 310' ' ' ILE . . . . . 0.656 HD12 HD22 ' A' ' 111' ' ' ASN . 40.5 mm -55.72 -53.09 41.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 60.24 111.189 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 311' ' ' SER . . . . . . . . . . . . . 35.0 t -63.97 -25.62 68.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 71.1 110.879 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 312' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' B' ' 308' ' ' GLU . . . -71.16 -9.75 58.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 74.11 111.144 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 313' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -106.53 14.47 27.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 72.3 110.902 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 314' ' ' PTR . . . . . 0.445 ' HE1' HG23 ' A' ' 117' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 315' ' ' SER . . . . . . . . . . . . . 86.1 p -113.66 -33.06 5.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.1 -1.409 . . . . 73.23 110.902 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 65.54 147.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 75.14 110.857 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 317' ' ' VAL . . . . . 0.404 HG23 ' O ' ' B' ' 317' ' ' VAL . 12.3 m -51.23 116.84 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.084 -0.507 . . . . 74.32 111.164 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 318' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -125.24 75.04 1.42 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 64.53 110.839 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 319' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt -54.6 160.32 2.81 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.616 0.722 . . . . 73.25 110.875 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 320' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 111.41 2.81 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.716 2.277 . . . . 73.15 112.301 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 321' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 CA-C-O 119.161 -0.8 . . . . 72.22 112.527 -179.974 . . . . . . . . 0 0 . 1 stop_ save_